2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine

C23H24N2 — CID 19863538

IUPAC2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine
SMILESc1ccc(-c2cc(CN3CCC(c4ccccc4)CC3)ccn2)cc1
InChIInChI=1S/C23H24N2/c1-3-7-20(8-4-1)21-12-15-25(16-13-21)18-19-11-14-24-23(17-19)22-9-5-2-6-10-22/h1-11,14,17,21H,12-13,15-16,18H2
InChIKeyXNMAZCCGDCYQPY-UHFFFAOYSA-N
MW328.46 g/mol
LogP5.13
Rot. Bonds4

About 2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine

2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine (PubChem CID 19863538) has the molecular formula C23H24N2 and a molecular weight of 328.46 g/mol. Its IUPAC name is 2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine.

Molecular Properties

Compound Name2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine
PubChem CID19863538
Molecular FormulaC23H24N2
Molecular Weight328.46 g/mol
Exact Mass328.19
IUPAC Name2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine
SMILESc1ccc(-c2cc(CN3CCC(c4ccccc4)CC3)ccn2)cc1
InChIInChI=1S/C23H24N2/c1-3-7-20(8-4-1)21-12-15-25(16-13-21)18-19-11-14-24-23(17-19)22-9-5-2-6-10-22/h1-11,14,17,21H,12-13,15-16,18H2
InChIKeyXNMAZCCGDCYQPY-UHFFFAOYSA-N
XLogP5.13
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.46
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenyl)-4-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]pyridine
CID 57181978
N-(4-methylphenyl)-N,1-bis[(2-phenyl-4-pyridinyl)methyl]piperidin-4-amine
CID 21352374
3-[(4-phenylpiperidin-1-yl)methyl]benzoic acid
CID 122028587
2-phenyl-6-[(4-phenylpiperidin-1-yl)methyl]pyridine
CID 19863623
2-[(4-phenylpiperidin-1-yl)methyl]-4-pyridin-2-ylphenol
CID 135906345
4-[(4-methylpiperidin-1-yl)methyl]-2-(3,4,5-trimethoxyphenyl)pyridine
CID 21338831
4-(3-cyclohexylphenyl)-2-phenylpyridine
CID 129074802
4-[(4-phenylpiperidin-1-yl)methyl]benzoic acid;hydrochloride
CID 146018012
2-phenyl-3-[(4-phenylpiperidin-1-yl)methyl]quinoline
CID 23497657
7-[(4-phenylpiperidin-1-yl)methyl]chromen-2-one
CID 10639353
2-phenyl-5-[(4-phenylpiperidin-1-yl)methyl]-1,3,4-oxadiazole
CID 46643022
4-(1-benzylpyrrolidin-3-yl)pyridine
CID 11085844

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine?
The IUPAC name of 2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine (CID 19863538) is 2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine.
What is the SMILES notation for 2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine?
The canonical SMILES for 2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine is c1ccc(-c2cc(CN3CCC(c4ccccc4)CC3)ccn2)cc1.
What is the InChIKey of 2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine?
The InChIKey is XNMAZCCGDCYQPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2/c1-3-7-20(8-4-1)21-12-15-25(16-13-21)18-19-11-14-24-23(17-19)22-9-5-2-6-10-22/h1-11,14,17,21H,12-13,15-16,18H2.
What are the key properties of 2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine?
2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine has a molecular weight of 328.46 g/mol, XLogP of 5.13, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine is sourced from PubChem (CID 19863538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).