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

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