N-benzyl-1-phenylcyclohexan-1-amine

C19H23N — CID 76851721

IUPACN-benzyl-1-phenylcyclohexan-1-amine
SMILESc1ccc(CNC2(c3ccccc3)CCCCC2)cc1
InChIInChI=1S/C19H23N/c1-4-10-17(11-5-1)16-20-19(14-8-3-9-15-19)18-12-6-2-7-13-18/h1-2,4-7,10-13,20H,3,8-9,14-16H2
InChIKeyQXDFOWJXUCIHGJ-UHFFFAOYSA-N
MW265.40 g/mol
LogP4.64
Rot. Bonds4

About N-benzyl-1-phenylcyclohexan-1-amine

N-benzyl-1-phenylcyclohexan-1-amine (PubChem CID 76851721) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is N-benzyl-1-phenylcyclohexan-1-amine.

Molecular Properties

Compound NameN-benzyl-1-phenylcyclohexan-1-amine
PubChem CID76851721
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC NameN-benzyl-1-phenylcyclohexan-1-amine
SMILESc1ccc(CNC2(c3ccccc3)CCCCC2)cc1
InChIInChI=1S/C19H23N/c1-4-10-17(11-5-1)16-20-19(14-8-3-9-15-19)18-12-6-2-7-13-18/h1-2,4-7,10-13,20H,3,8-9,14-16H2
InChIKeyQXDFOWJXUCIHGJ-UHFFFAOYSA-N
XLogP4.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-phenyl-N-[(4-piperidin-1-ylphenyl)methyl]cyclobutan-1-amine
CID 75418740
N-(2-fluoroethyl)-1-phenylcyclohexan-1-amine
CID 175837141
1-phenyl-N-(pyridin-2-ylmethyl)cyclopentan-1-amine
CID 126726884
2-[(1-phenylcyclohexyl)amino]acetic acid;hydrochloride
CID 175015594
1-phenyl-N-propan-2-ylcyclohexan-1-amine;hydrochloride
CID 53299308
N-(1,1,2,2,2-pentadeuterioethyl)-1-phenylcyclohexan-1-amine;hydrochloride
CID 71315071
N-(1-phenylcyclooctyl)hydroxylamine
CID 163440623
N-benzyl-1-(1-phenyltetrazol-5-yl)cyclohexan-1-amine
CID 30312000
N-benzyl-1-methylcyclopentan-1-amine;hydrochloride
CID 171397400
1-(benzylamino)cycloheptane-1-carboxylic acid
CID 60991600
acetic acid;azane;N-ethyl-1-phenylcyclohexan-1-amine
CID 19095095
(5S)-3-[4-[1-(benzylamino)cyclohexyl]phenyl]-5-(methoxymethyl)-1,3-oxazolidin-2-one
CID 70051911

Frequently Asked Questions

What is the IUPAC name of N-benzyl-1-phenylcyclohexan-1-amine?
The IUPAC name of N-benzyl-1-phenylcyclohexan-1-amine (CID 76851721) is N-benzyl-1-phenylcyclohexan-1-amine.
What is the SMILES notation for N-benzyl-1-phenylcyclohexan-1-amine?
The canonical SMILES for N-benzyl-1-phenylcyclohexan-1-amine is c1ccc(CNC2(c3ccccc3)CCCCC2)cc1.
What is the InChIKey of N-benzyl-1-phenylcyclohexan-1-amine?
The InChIKey is QXDFOWJXUCIHGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N/c1-4-10-17(11-5-1)16-20-19(14-8-3-9-15-19)18-12-6-2-7-13-18/h1-2,4-7,10-13,20H,3,8-9,14-16H2.
What are the key properties of N-benzyl-1-phenylcyclohexan-1-amine?
N-benzyl-1-phenylcyclohexan-1-amine has a molecular weight of 265.40 g/mol, XLogP of 4.64, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-1-phenylcyclohexan-1-amine is sourced from PubChem (CID 76851721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).