benzene;N-benzylcyclohexanamine

C19H25N — CID 142622843

IUPACbenzene;N-benzylcyclohexanamine
SMILESc1ccc(CNC2CCCCC2)cc1.c1ccccc1
InChIInChI=1S/C13H19N.C6H6/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13;1-2-4-6-5-3-1/h1,3-4,7-8,13-14H,2,5-6,9-11H2;1-6H
InChIKeyPREUYDMBKYBZDB-UHFFFAOYSA-N
MW267.42 g/mol
LogP4.80
Rot. Bonds3

About benzene;N-benzylcyclohexanamine

benzene;N-benzylcyclohexanamine (PubChem CID 142622843) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is benzene;N-benzylcyclohexanamine.

Molecular Properties

Compound Namebenzene;N-benzylcyclohexanamine
PubChem CID142622843
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC Namebenzene;N-benzylcyclohexanamine
SMILESc1ccc(CNC2CCCCC2)cc1.c1ccccc1
InChIInChI=1S/C13H19N.C6H6/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13;1-2-4-6-5-3-1/h1,3-4,7-8,13-14H,2,5-6,9-11H2;1-6H
InChIKeyPREUYDMBKYBZDB-UHFFFAOYSA-N
XLogP4.80
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[(cyclohexylamino)methyl]-N-phenylaniline
CID 69114747
N-[(4-phenylmethoxyphenyl)methyl]cyclooctanamine
CID 4723001
N-[[4-(2-phenoxyethoxy)phenyl]methyl]cyclohexanamine
CID 54797686
N-benzyloxepan-4-amine
CID 65076712
N-(pyridin-4-ylmethyl)cyclooctanamine
CID 4722994
N-[(4-bromophenyl)methyl]cycloheptanamine;hydrochloride
CID 17294485
4-[(cyclopentylamino)methyl]phenol
CID 3873791
N-[(3,5-dichloro-4-phenylmethoxyphenyl)methyl]cyclohexanamine
CID 35698068
N-[(3,5-dichloro-4-phenylmethoxyphenyl)methyl]cycloheptanamine
CID 35698685
cis-(1S,2R)-2-(benzylamino)cyclooctan-1-ol
CID 129411683
N-benzyl-1-methylpiperidin-4-amine
CID 1114650
N-benzyl-N'-cyclobutylethane-1,2-diamine
CID 71627766

Frequently Asked Questions

What is the IUPAC name of benzene;N-benzylcyclohexanamine?
The IUPAC name of benzene;N-benzylcyclohexanamine (CID 142622843) is benzene;N-benzylcyclohexanamine.
What is the SMILES notation for benzene;N-benzylcyclohexanamine?
The canonical SMILES for benzene;N-benzylcyclohexanamine is c1ccc(CNC2CCCCC2)cc1.c1ccccc1.
What is the InChIKey of benzene;N-benzylcyclohexanamine?
The InChIKey is PREUYDMBKYBZDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N.C6H6/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13;1-2-4-6-5-3-1/h1,3-4,7-8,13-14H,2,5-6,9-11H2;1-6H.
What are the key properties of benzene;N-benzylcyclohexanamine?
benzene;N-benzylcyclohexanamine has a molecular weight of 267.42 g/mol, XLogP of 4.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;N-benzylcyclohexanamine is sourced from PubChem (CID 142622843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).