[(AMINOCYCLOHEXYL)METHYL]ANILINE

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Keyword(s): Human Metabolites
Molecule Category Free-form

Structure

InChI Key YGGKCQDWJXVRPL-UHFFFAOYSA-N
Smiles NC=1C=CC=CC1CC2(N)CCCCC2
InChI
InChI=1/C13H20N2/c14-12-7-3-2-6-11(12)10-13(15)8-4-1-5-9-13/h2-3,6-7H,1,4-5,8-10,14-15H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C13H20N2
Molecular Weight 204.16
AlogP 2.47
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 2.0
Polar Surface Area 52.04
Heavy Atoms 15.0

Cross References

Resources Reference
CAS NUMBER 84681-76-5
NORMAN SUSDAT
PubChem 3020022
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