3-[2-(4-phenylphenyl)cyclohexyl]pyridine

C23H23N — CID 175611155

IUPAC3-[2-(4-phenylphenyl)cyclohexyl]pyridine
SMILESc1ccc(-c2ccc(C3CCCCC3c3cccnc3)cc2)cc1
InChIInChI=1S/C23H23N/c1-2-7-18(8-3-1)19-12-14-20(15-13-19)22-10-4-5-11-23(22)21-9-6-16-24-17-21/h1-3,6-9,12-17,22-23H,4-5,10-11H2
InChIKeyJFEFCUAQCKWKHN-UHFFFAOYSA-N
MW313.44 g/mol
LogP6.19
Rot. Bonds3

About 3-[2-(4-phenylphenyl)cyclohexyl]pyridine

3-[2-(4-phenylphenyl)cyclohexyl]pyridine (PubChem CID 175611155) has the molecular formula C23H23N and a molecular weight of 313.44 g/mol. Its IUPAC name is 3-[2-(4-phenylphenyl)cyclohexyl]pyridine.

Molecular Properties

Compound Name3-[2-(4-phenylphenyl)cyclohexyl]pyridine
PubChem CID175611155
Molecular FormulaC23H23N
Molecular Weight313.44 g/mol
Exact Mass313.18
IUPAC Name3-[2-(4-phenylphenyl)cyclohexyl]pyridine
SMILESc1ccc(-c2ccc(C3CCCCC3c3cccnc3)cc2)cc1
InChIInChI=1S/C23H23N/c1-2-7-18(8-3-1)19-12-14-20(15-13-19)22-10-4-5-11-23(22)21-9-6-16-24-17-21/h1-3,6-9,12-17,22-23H,4-5,10-11H2
InChIKeyJFEFCUAQCKWKHN-UHFFFAOYSA-N
XLogP6.19
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500313.44
LogP ≤ 56.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-pyridin-3-ylcyclohexane-1-carbonitrile
CID 82241004
2-phenyl-N-(pyridin-3-ylmethyl)cyclohexan-1-amine
CID 43769450
3-[3-(4-methylphenyl)piperidin-4-yl]pyridine
CID 79441307
2-(2-pyridin-3-ylcyclohexyl)acetonitrile
CID 82241256
[(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine
CID 138571732
3-(2-methylcyclobutyl)pyridine
CID 174716389
3-(2-bromocyclobutyl)pyridine
CID 142785630
N-ethyl-2-pyridin-3-ylcycloheptan-1-amine
CID 62604063
3-[(1R,2R)-2-methylcyclopropyl]pyridine
CID 59474162
3-(2-bromocyclopropyl)pyridine
CID 130539890
3-[3-(4-chlorophenyl)piperidin-4-yl]pyridine
CID 79434183
N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine
CID 81027798

Frequently Asked Questions

What is the IUPAC name of 3-[2-(4-phenylphenyl)cyclohexyl]pyridine?
The IUPAC name of 3-[2-(4-phenylphenyl)cyclohexyl]pyridine (CID 175611155) is 3-[2-(4-phenylphenyl)cyclohexyl]pyridine.
What is the SMILES notation for 3-[2-(4-phenylphenyl)cyclohexyl]pyridine?
The canonical SMILES for 3-[2-(4-phenylphenyl)cyclohexyl]pyridine is c1ccc(-c2ccc(C3CCCCC3c3cccnc3)cc2)cc1.
What is the InChIKey of 3-[2-(4-phenylphenyl)cyclohexyl]pyridine?
The InChIKey is JFEFCUAQCKWKHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N/c1-2-7-18(8-3-1)19-12-14-20(15-13-19)22-10-4-5-11-23(22)21-9-6-16-24-17-21/h1-3,6-9,12-17,22-23H,4-5,10-11H2.
What are the key properties of 3-[2-(4-phenylphenyl)cyclohexyl]pyridine?
3-[2-(4-phenylphenyl)cyclohexyl]pyridine has a molecular weight of 313.44 g/mol, XLogP of 6.19, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(4-phenylphenyl)cyclohexyl]pyridine is sourced from PubChem (CID 175611155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).