CHEBI:43689 - isopentylamine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name isopentylamine
ChEBI ID CHEBI:43689
Definition A primary aliphatic amine that is butan-1-amine carrying a methyl substituent at position 3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C5H13N
Net Charge 0
Average Mass 87.16340
Monoisotopic Mass 87.105
InChI InChI=1S/C5H13N/c1-5(2)3-4-6/h5H,3-4,6H2,1-2H3
InChIKey BMFVGAAISNGQNM-UHFFFAOYSA-N
SMILES CC(C)CCN
Roles Classification
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.
bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing isopentylamine (CHEBI:43689) has role bacterial metabolite (CHEBI:76969)
isopentylamine (CHEBI:43689) has role plant metabolite (CHEBI:76924)
isopentylamine (CHEBI:43689) is a primary aliphatic amine (CHEBI:17062)
IUPAC Name
3-methylbutan-1-amine
Synonyms Sources
1-Amino-3-methylbutane ChemIDplus
3,3-Dimethylpropylamine ChemIDplus
3-Methylbutanamine ChemIDplus
gamma-Isoamylamine ChemIDplus
Isoamylamine KEGG COMPOUND
Isobutylcarbylamine ChemIDplus
Isopentylamine KEGG COMPOUND
Isopentylamine ChemIDplus
Isovalerylamine ChemIDplus
Leucamine NIST Chemistry WebBook
Database Links Databases
C02640 KEGG COMPOUND
HMDB0031659 HMDB
LEN PDBeChem
View more database links
Registry Numbers Types Sources
107-85-7 CAS Registry Number NIST Chemistry WebBook
107-85-7 CAS Registry Number ChemIDplus
1209230 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
24323937 PubMed citation Europe PMC
358746 PubMed citation Europe PMC
7672735 PubMed citation Europe PMC
Last Modified
28 July 2014