1-[1-(4-phenylphenyl)cyclohexyl]piperidine

C23H29N — CID 12704483

IUPAC1-[1-(4-phenylphenyl)cyclohexyl]piperidine
SMILESc1ccc(-c2ccc(C3(N4CCCCC4)CCCCC3)cc2)cc1
InChIInChI=1S/C23H29N/c1-4-10-20(11-5-1)21-12-14-22(15-13-21)23(16-6-2-7-17-23)24-18-8-3-9-19-24/h1,4-5,10-15H,2-3,6-9,16-19H2
InChIKeyXZRYYXBUPYYHPL-UHFFFAOYSA-N
MW319.49 g/mol
LogP6.00
Rot. Bonds3

About 1-[1-(4-phenylphenyl)cyclohexyl]piperidine

1-[1-(4-phenylphenyl)cyclohexyl]piperidine (PubChem CID 12704483) has the molecular formula C23H29N and a molecular weight of 319.49 g/mol. Its IUPAC name is 1-[1-(4-phenylphenyl)cyclohexyl]piperidine.

Molecular Properties

Compound Name1-[1-(4-phenylphenyl)cyclohexyl]piperidine
PubChem CID12704483
Molecular FormulaC23H29N
Molecular Weight319.49 g/mol
Exact Mass319.23
IUPAC Name1-[1-(4-phenylphenyl)cyclohexyl]piperidine
SMILESc1ccc(-c2ccc(C3(N4CCCCC4)CCCCC3)cc2)cc1
InChIInChI=1S/C23H29N/c1-4-10-20(11-5-1)21-12-14-22(15-13-21)23(16-6-2-7-17-23)24-18-8-3-9-19-24/h1,4-5,10-15H,2-3,6-9,16-19H2
InChIKeyXZRYYXBUPYYHPL-UHFFFAOYSA-N
XLogP6.00
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500319.49
LogP ≤ 56.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-[1-(4-phenylphenyl)cyclohexyl]piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-phenylphenyl)cyclohexyl]piperidine?
The IUPAC name of 1-[1-(4-phenylphenyl)cyclohexyl]piperidine (CID 12704483) is 1-[1-(4-phenylphenyl)cyclohexyl]piperidine.
What is the SMILES notation for 1-[1-(4-phenylphenyl)cyclohexyl]piperidine?
The canonical SMILES for 1-[1-(4-phenylphenyl)cyclohexyl]piperidine is c1ccc(-c2ccc(C3(N4CCCCC4)CCCCC3)cc2)cc1.
What is the InChIKey of 1-[1-(4-phenylphenyl)cyclohexyl]piperidine?
The InChIKey is XZRYYXBUPYYHPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N/c1-4-10-20(11-5-1)21-12-14-22(15-13-21)23(16-6-2-7-17-23)24-18-8-3-9-19-24/h1,4-5,10-15H,2-3,6-9,16-19H2.
What are the key properties of 1-[1-(4-phenylphenyl)cyclohexyl]piperidine?
1-[1-(4-phenylphenyl)cyclohexyl]piperidine has a molecular weight of 319.49 g/mol, XLogP of 6.00, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-phenylphenyl)cyclohexyl]piperidine is sourced from PubChem (CID 12704483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).