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CHEBI:84267 - N-methylbutan-2-amine

ChEBI IDCHEBI:84267
ChEBI NameN-methylbutan-2-amine
Stars
ASCII NameN-methylbutan-2-amine
DefinitionA secondary aliphatic amine that is sec-butylamine substituted by a methyl group at the N atom. Metabolite observed in cancer metabolism.
Last Modified14 January 2015
Submitternamrata
DownloadsMolfile
FormulaC5H13N
Net Charge0
Average Mass87.166
Monoisotopic Mass87.10480
SMILESCCC(C)NC
InChIInChI=1S/C5H13N/c1-4-5(2)6-3/h5-6H,4H2,1-3H3
InChIKeyPYFSCIWXNSXGNS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
- PubMed (25518943) Metabolite observed in cancer metabolism.
- MetaboLights (MTBLS150)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
N-methylbutan-2-amine (CHEBI:84267) has functional parent sec-butylamine (CHEBI:74526)
N-methylbutan-2-amine (CHEBI:84267) has role human metabolite (CHEBI:77746)
N-methylbutan-2-amine (CHEBI:84267) is a secondary aliphatic amine (CHEBI:50981)
IUPAC Name 
N-methylbutan-2-amine
Synonyms  Source
N-methyl-2-butanamineChEBI
N,1-dimethylpropylamineChemIDplus
Registry NumbersSources
Reaxys:1361350Reaxys
CAS:7713-69-1ChemIDplus
Citations