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CHEBI:84245 - 2,4-dimethylpentan-3-amine

ChEBI IDCHEBI:84245
ChEBI Name2,4-dimethylpentan-3-amine
Stars
DefinitionA primary aliphatic amine that is pentan-3-amine substituted by methyl groups at positions 2 and 4. Metabolite observed in cancer metabolism.
Last Modified14 January 2015
Submitternamrata
DownloadsMolfile
FormulaC7H17N
Net Charge0
Average Mass115.220
Monoisotopic Mass115.13610
SMILESCC(C)C(N)C(C)C
InChIInChI=1S/C7H17N/c1-5(2)7(8)6(3)4/h5-7H,8H2,1-4H3
InChIKeyFATQVQVMXNESGD-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)
2,4-dimethylpentan-3-amine (CHEBI:84245) has role human metabolite (CHEBI:77746)
2,4-dimethylpentan-3-amine (CHEBI:84245) is a primary aliphatic amine (CHEBI:17062)
IUPAC Name 
2,4-dimethylpentan-3-amine
Synonyms  Source
2,4-dimethyl-3-aminopentaneChEBI
diisopropylmethylamineChEBI
1-isopropyl-2-methylpropylamineChEBI
3-amino-2,4-dimethylpentaneChEBI
Registry NumbersSources
Reaxys:1731599Reaxys
CAS:4083-57-2ChemIDplus
Citations