CHEBI:78856 - 2-methyl-1-pyrroline

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-methyl-1-pyrroline
ChEBI ID CHEBI:78856
Definition A member of the class of pyrrolines that is 1-pyrroline substituted at position 2 by a methyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C5H9N
Net Charge 0
Average Mass 83.13170
Monoisotopic Mass 83.07350
InChI InChI=1S/C5H9N/c1-5-3-2-4-6-5/h2-4H2,1H3
InChIKey CTSZPNIMMLSKDV-UHFFFAOYSA-N
SMILES CC1=NCCC1
ChEBI Ontology
Outgoing 2-methyl-1-pyrroline (CHEBI:78856) is a imine (CHEBI:24783)
2-methyl-1-pyrroline (CHEBI:78856) is a pyrroline (CHEBI:23763)
2-methyl-1-pyrroline (CHEBI:78856) is conjugate base of 2-methyl-1-pyrrolinium (CHEBI:78220)
Incoming 2-methyl-1-pyrrolinium (CHEBI:78220) is conjugate acid of 2-methyl-1-pyrroline (CHEBI:78856)
IUPAC Name
5-methyl-3,4-dihydro-2H-pyrrole
Synonym Source
3,4-Dihydro-5-methyl-2H-pyrrole ChemIDplus
Manual Xref Database
CPD-16510 MetaCyc
View more database links
Registry Numbers Types Sources
103485 Reaxys Registry Number Reaxys
872-32-2 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
21897027 PubMed citation Europe PMC
Last Modified
16 June 2014