Cyclohexylamine; N-Formyl 

AlkaPlorer ID: AK029331

Synonym: N-Cyclohexylformamide 

IUPAC Name: N-cyclohexylformamide

Structure

SMILES: OC=NC1CCCCC1

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InChI: InChI=1S/C7H13NO/c9-6-8-7-4-2-1-3-5-7/h6-7H,1-5H2,(H,8,9)

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InChIKey: SWGXDLRCJNEEGZ-UHFFFAOYSA-N

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Reference

PubChem CID: 13017

CAS: 766-93-8

LOTUS: LTS0150993

NPASS: NPC324539

COCONUT: CNP0083588

Source

Species Genus Family Order Class Phylum Kingdom Domain
Mus musculus Mus Muridae Rodentia Mammalia Chordata Metazoa Eukaryota

Properties Information

Molecule Weight: 127.187

TPSA: 32.59

MolLogP: 1.9054

Number of H-Donors: 1

Number of H-Acceptors: 1

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Equus caballus Alcohol dehydrogenase Ki 8700.0 nM 10.1021/jm9707380
Homo sapiens Alcohol dehydrogenase alpha chain Ki 2300.0 nM 10.1021/jm9707380
Homo sapiens Alcohol dehydrogenase beta chain Ki 3400.0 nM 10.1021/jm9707380
Homo sapiens Alcohol dehydrogenase class II Ki 84000.0 nM 10.1021/jm9707380
Homo sapiens Alcohol dehydrogenase class IV Ki 380000.0 nM 10.1021/jm9707380
Homo sapiens Alcohol dehydrogenase gamma chain Ki 5200.0 nM 10.1021/jm9707380

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT001299 C#[N+]C1CCCCC1>>O=CNC1CCCCC1 R05771
AKRT023712 O=CNC1CCCCC1>>NC1CCCCC1 R06940
AKRT023713 O=CNC1CCCCC1>>O=CO R06940