EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:78856 - 2-methyl-1-pyrroline

ChEBI IDCHEBI:78856
ChEBI Name2-methyl-1-pyrroline
Stars
DefinitionA member of the class of pyrrolines that is 1-pyrroline substituted at position 2 by a methyl group.
Last Modified16 June 2014
SubmitterSteve
DownloadsMolfile
FormulaC5H9N
Net Charge0
Average Mass83.134
Monoisotopic Mass83.07350
SMILESCC1=NCCC1
InChIInChI=1S/C5H9N/c1-5-3-2-4-6-5/h2-4H2,1H3
InChIKeyCTSZPNIMMLSKDV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
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 Relation(s)
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-pyrroleChemIDplus
Manual XrefsDatabases
CPD-16510MetaCyc
Registry NumbersSources
Reaxys:103485Reaxys
CAS:872-32-2ChemIDplus
Citations