2-phenyl-6-[(4-phenylpiperidin-1-yl)methyl]pyridine

C23H24N2 — CID 19863623

IUPAC2-phenyl-6-[(4-phenylpiperidin-1-yl)methyl]pyridine
SMILESc1ccc(-c2cccc(CN3CCC(c4ccccc4)CC3)n2)cc1
InChIInChI=1S/C23H24N2/c1-3-8-19(9-4-1)20-14-16-25(17-15-20)18-22-12-7-13-23(24-22)21-10-5-2-6-11-21/h1-13,20H,14-18H2
InChIKeyMYQULBVOXOYBQL-UHFFFAOYSA-N
MW328.46 g/mol
LogP5.13
Rot. Bonds4

About 2-phenyl-6-[(4-phenylpiperidin-1-yl)methyl]pyridine

2-phenyl-6-[(4-phenylpiperidin-1-yl)methyl]pyridine (PubChem CID 19863623) has the molecular formula C23H24N2 and a molecular weight of 328.46 g/mol. Its IUPAC name is 2-phenyl-6-[(4-phenylpiperidin-1-yl)methyl]pyridine.

Molecular Properties

Compound Name2-phenyl-6-[(4-phenylpiperidin-1-yl)methyl]pyridine
PubChem CID19863623
Molecular FormulaC23H24N2
Molecular Weight328.46 g/mol
Exact Mass328.19
IUPAC Name2-phenyl-6-[(4-phenylpiperidin-1-yl)methyl]pyridine
SMILESc1ccc(-c2cccc(CN3CCC(c4ccccc4)CC3)n2)cc1
InChIInChI=1S/C23H24N2/c1-3-8-19(9-4-1)20-14-16-25(17-15-20)18-22-12-7-13-23(24-22)21-10-5-2-6-11-21/h1-13,20H,14-18H2
InChIKeyMYQULBVOXOYBQL-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-phenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyridine
CID 19863538
2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine
CID 16667834
2-phenyl-3-[(4-phenylpiperidin-1-yl)methyl]quinoline
CID 23497657
2-phenyl-5-[(4-phenylpiperidin-1-yl)methyl]-1,3,4-oxadiazole
CID 46643022
6-chloro-3-[1-[(6-phenyl-2-pyridinyl)methyl]piperidin-4-yl]-1H-benzimidazol-2-one
CID 19863552
2-[3-(4-ethoxyphenyl)phenyl]-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-thiazole
CID 24720751
2-[[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]methyl]-6-phenylpyridine
CID 57108240
2-[(4-phenylpiperidin-1-yl)methyl]-4-pyridin-2-ylphenol
CID 135906345
2-(fluoromethyl)-6-phenylpyridine
CID 58240037
1,7-dimethyl-2-[(4-phenylpiperidin-1-yl)methyl]benzimidazole
CID 24849559
1-(2-chloroethyl)-4-phenylpiperidine
CID 13195407
2-[4-((1,2,3,4,5,6-13C6)cyclohexatrienyl)(3,4,5-13C3)azinan-1-yl]-1,1,2,2-tetradeuterio(113C)ethanamine
CID 89308417

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-6-[(4-phenylpiperidin-1-yl)methyl]pyridine?
The IUPAC name of 2-phenyl-6-[(4-phenylpiperidin-1-yl)methyl]pyridine (CID 19863623) is 2-phenyl-6-[(4-phenylpiperidin-1-yl)methyl]pyridine.
What is the SMILES notation for 2-phenyl-6-[(4-phenylpiperidin-1-yl)methyl]pyridine?
The canonical SMILES for 2-phenyl-6-[(4-phenylpiperidin-1-yl)methyl]pyridine is c1ccc(-c2cccc(CN3CCC(c4ccccc4)CC3)n2)cc1.
What is the InChIKey of 2-phenyl-6-[(4-phenylpiperidin-1-yl)methyl]pyridine?
The InChIKey is MYQULBVOXOYBQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2/c1-3-8-19(9-4-1)20-14-16-25(17-15-20)18-22-12-7-13-23(24-22)21-10-5-2-6-11-21/h1-13,20H,14-18H2.
What are the key properties of 2-phenyl-6-[(4-phenylpiperidin-1-yl)methyl]pyridine?
2-phenyl-6-[(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-6-[(4-phenylpiperidin-1-yl)methyl]pyridine is sourced from PubChem (CID 19863623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).