CHEBI:59018 - N-methylcyclohexylamine

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ChEBI Name N-methylcyclohexylamine
ChEBI ID CHEBI:59018
ChEBI ASCII Name N-methylcyclohexylamine
Definition A secondary aliphatic amine having methyl and cyclohexyl as the two alkyl groups.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C7H15N
Net Charge 0
Average Mass 113.20070
Monoisotopic Mass 113.120
InChI InChI=1S/C7H15N/c1-8-7-5-3-2-4-6-7/h7-8H,2-6H2,1H3
InChIKey XTUVJUMINZSXGF-UHFFFAOYSA-N
SMILES CNC1CCCCC1
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): human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
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ChEBI Ontology
Outgoing N-methylcyclohexylamine (CHEBI:59018) has role human xenobiotic metabolite (CHEBI:76967)
N-methylcyclohexylamine (CHEBI:59018) is a secondary aliphatic amine (CHEBI:50981)
IUPAC Name
N-methylcyclohexanamine
Synonyms Sources
(Methylamino)cyclohexane ChemIDplus
1-Methylcyclohexylamine NIST Chemistry WebBook
Cyclohexylmethylamine ChemIDplus
Methylcyclohexylamine ChemIDplus
N-Cyclohexyl-N-methylamine NIST Chemistry WebBook
N-Cyclohexylmethylamine ChemIDplus
N-Methyl-N-cyclohexylamine ChemIDplus
N-Methylcyclohexanamine ChemIDplus
Registry Numbers Types Sources
100-60-7 CAS Registry Number NIST Chemistry WebBook
100-60-7 CAS Registry Number ChemIDplus
1523664 Beilstein Registry Number Beilstein
1523664 Reaxys Registry Number Reaxys
363150 Gmelin Registry Number Gmelin
Citation Waiting for Citations Type Source
1249163 PubMed citation Europe PMC
Last Modified
24 April 2014
General Comment
2014-04-24 It is found in the urine samples of humans administered with bromhexine.