1-methylpyrrolidine
fo-2f5b32c076077a9b
Identity
- Type
- Neutral molecule
- CAS
- 120-94-5
- EC
- 204-438-5
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 57 across every transformer
Structure
What it is used for
2
Roles, not types. A substance bears as many as apply — sulfluramid is an
insecticide and an acaricide — and each is a class ChEBI curates, asserted
with ChEBI’s own has role. The narrow ones publish the broad
ones alongside them, so a substance filed as a herbicide is a pesticide
here too. See agricultural
chemicals for what the axis is and which classes are published.
| Role | Definition | Evidence |
|---|---|---|
| insecticide CHEBI:24852 | Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects. | ChEBI |
| pesticide CHEBI:25944 | Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. | ChEBI |
Alternative labels
3- N-methylpyrrolidine
- N-methyltetrahydropyrrole
- Pyrrolidine, 1-methyl-
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | AVFZOVWCLRSYKC-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C5H11N/c1-6-4-2-3-5-6/h2-5H2,1H3 |
| IUPAC name chemrof:IUPAC_name | 1-methylpyrrolidine |
| Molecular formula chemrof:molecular_formula | C5H11N |
| Molecular mass chemrof:molecular_mass | 85.15 |
| Monoisotopic mass chemrof:monoisotopic_mass | 85.089149, 85.08915 |
| SMILES string chemrof:smiles_string | CN1CCCC1 |
Known URLs
23Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| agr | agr:IND607173169 | enrich_references.chebi_xrefs |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=120-94-5 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:234043 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.004.035 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID8042210 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=65579 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL665 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/06509TZU6C | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0243946 | enrich_references.chebi_xrefs |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J102.087K | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/8454 | enrich_references.pubchem_compound |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/14623607 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/19772725 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/20949500 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21044414 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/28322563 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/2893706 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/29772172 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/33436206 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/38993039 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/5955949 | enrich_references.chebi_xrefs |
| reaxys | reaxys:102445 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q24574865 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| f513c148-5017-4490-8fca-7963ddf9bef6 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 97ebb0dc-b4ec-4662-abad-0ae0480ebb3e | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 686dade9-0899-4abe-b88c-5eaa20cbfe58 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| f18b508a-6ed4-4460-9e9b-7ede22bab85f | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| ce9ff773-b498-4863-9ecb-2d6bffaf806a | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| df639b22-1f65-4324-9b4a-408e0fd013ad | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| e461a53d-54a7-4833-98bf-737b6ee3bd35 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 25c4762a-8262-4847-b7ab-7b1f67e76412 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| f24e57a8-1561-4c4e-8f6e-04008b928be0 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| f19b0b50-fc10-4a97-90c3-886cee83e679 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| b24effb9-23b7-4ba0-90d9-92bc9f68c76e | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 9a2f23b8-5038-4430-aefa-7be5bbed46b1 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| ab40334d-3161-4375-9543-25780308eb4f | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (57 changes)
Full record
Flow object JSON
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Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works