CHEBI:15997 - 2-methylpropanamine

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ChEBI Name 2-methylpropanamine
ChEBI ID CHEBI:15997
Definition An alkylamine having isobutyl as the alkyl group. It has been isolated from Sambucus nigra (Elderberry).
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:1211, CHEBI:11626, CHEBI:19709
Supplier Information ChemicalBook:CB9211238, eMolecules:523461, ZINC000004658586
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Isobutylamine is an organic chemical compound (specifically, an amine) with the formula (CH3)2CHCH2NH2, and occurs as a colorless liquid. Isobutylamine is one of the four isomeric amines of butane, the others being n-butylamine, sec-butylamine and tert-butylamine. It is the decarboxylated form of the amino acid valine, and the product of the metabolism thereof by the enzyme valine decarboxylase. Isobutylamine is an odorant binding to TAAR3 in mice and can trigger sexual behaviour in male mice dependent on the cluster of TAAR2 through TAAR9.
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Formulae C4H11N
C4H11N
Net Charge 0
Average Mass 73.137
Monoisotopic Mass 73.08915
InChI InChI=1S/C4H11N/c1-4(2)3-5/h4H,3,5H2,1-2H3
InChIKey KDSNLYIMUZNERS-UHFFFAOYSA-N
SMILES C(N)C(C)C
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
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ChEBI Ontology
Outgoing 2-methylpropanamine (CHEBI:15997) has role plant metabolite (CHEBI:76924)
2-methylpropanamine (CHEBI:15997) is a alkylamines (CHEBI:22331)
2-methylpropanamine (CHEBI:15997) is conjugate base of 2-methylpropanaminium (CHEBI:57601)
Incoming β-sanshool (CHEBI:66166) has functional parent 2-methylpropanamine (CHEBI:15997)
γ-sanshool (CHEBI:66167) has functional parent 2-methylpropanamine (CHEBI:15997)
N-hydroxy-2-methylpropanamine (CHEBI:131928) has functional parent 2-methylpropanamine (CHEBI:15997)
pipercallosidine (CHEBI:69688) has functional parent 2-methylpropanamine (CHEBI:15997)
pipercallosine (CHEBI:69685) has functional parent 2-methylpropanamine (CHEBI:15997)
2-methylpropanaminium (CHEBI:57601) is conjugate acid of 2-methylpropanamine (CHEBI:15997)
IUPAC Name
2-methylpropanamine
Synonyms Sources
1-Amino-2-methylpropane ChemIDplus
2-Methyl-1-Aminopropane NIST Chemistry WebBook
2-methyl-1-propanamine ChEBI
2-Methyl-1-propanamine KEGG COMPOUND
2-Methylpropanamine KEGG COMPOUND
2-Methylpropylamine ChemIDplus
3-Methyl-2-propylamine ChemIDplus
I-Butylamine ChemIDplus
IBA NIST Chemistry WebBook
iso-Butylamine ChemIDplus
iso-C4H9NH2 NIST Chemistry WebBook
Isobutylamine KEGG COMPOUND
Monoisobutylamine ChemIDplus
Valamine ChemIDplus
Manual Xrefs Databases
C02787 KEGG COMPOUND
CPD-630 MetaCyc
HMDB0034198 HMDB
IBN PDBeChem
Isobutylamine Wikipedia
View more database links
Registry Numbers Types Sources
385626 Reaxys Registry Number Reaxys
78-81-9 CAS Registry Number KEGG COMPOUND
78-81-9 CAS Registry Number NIST Chemistry WebBook
78-81-9 CAS Registry Number ChemIDplus
81862 Gmelin Registry Number Gmelin
Citation
Ghenghesh KS, Drucker DB (1989)
Gas liquid chromatography of amines produced by the Enterobacteriaceae.
Brazilian journal of medical and biological research = Revista brasileira de pesquisas medicas e biologicas 22, 653-665 [PubMed:2620174]
[show Abstract]
Last Modified
26 May 2016