[4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol

C24H26N2O — CID 110249251

IUPAC[4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol
SMILESOCc1ccc(-c2cccc(C3CCCN(Cc4ccccc4)C3)n2)cc1
InChIInChI=1S/C24H26N2O/c27-18-20-11-13-21(14-12-20)23-9-4-10-24(25-23)22-8-5-15-26(17-22)16-19-6-2-1-3-7-19/h1-4,6-7,9-14,22,27H,5,8,15-18H2
InChIKeyWPLCXVSYRNPXHX-UHFFFAOYSA-N
MW358.49 g/mol
LogP4.62
Rot. Bonds5

About [4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol

[4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol (PubChem CID 110249251) has the molecular formula C24H26N2O and a molecular weight of 358.49 g/mol. Its IUPAC name is [4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol.

Molecular Properties

Compound Name[4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol
PubChem CID110249251
Molecular FormulaC24H26N2O
Molecular Weight358.49 g/mol
Exact Mass358.20
IUPAC Name[4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol
SMILESOCc1ccc(-c2cccc(C3CCCN(Cc4ccccc4)C3)n2)cc1
InChIInChI=1S/C24H26N2O/c27-18-20-11-13-21(14-12-20)23-9-4-10-24(25-23)22-8-5-15-26(17-22)16-19-6-2-1-3-7-19/h1-4,6-7,9-14,22,27H,5,8,15-18H2
InChIKeyWPLCXVSYRNPXHX-UHFFFAOYSA-N
XLogP4.62
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[[(3S)-3-(2-methylpyrimidin-4-yl)piperidin-1-yl]methyl]phenyl]benzoic acid
CID 124973403
2-(3-methylphenyl)-6-[(3S)-1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine
CID 95809141
2-(3-fluorophenyl)-6-[(3R)-1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine
CID 95809146
[4-[6-[(3R)-1-(1H-indol-5-ylmethyl)piperidin-3-yl]pyrazin-2-yl]phenyl]methanol
CID 95820106
2-(2-fluorophenyl)-6-[(3S)-1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine
CID 95809145
2-(2-fluorophenyl)-6-[(3R)-1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine
CID 95809144
1-[(3R)-3-[6-[4-(hydroxymethyl)phenyl]pyrazin-2-yl]piperidin-1-yl]-2-phenoxyethanone
CID 95819716
[4-[[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]methyl]phenyl]methanol
CID 110009367
1-[(3S)-3-[6-(4-methoxyphenyl)-2-pyridinyl]piperidin-1-yl]-2-phenylethanone
CID 95809337
4-(1-benzylpiperidin-3-yl)-2-(methoxymethyl)pyrimidine
CID 141454585
cyclopentyl-[3-[6-[3-(hydroxymethyl)phenyl]-2-pyridinyl]piperidin-1-yl]methanone
CID 110249697
[4-[[3-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]phenyl]methanol
CID 110008771

Frequently Asked Questions

What is the IUPAC name of [4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol?
The IUPAC name of [4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol (CID 110249251) is [4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol.
What is the SMILES notation for [4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol?
The canonical SMILES for [4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol is OCc1ccc(-c2cccc(C3CCCN(Cc4ccccc4)C3)n2)cc1.
What is the InChIKey of [4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol?
The InChIKey is WPLCXVSYRNPXHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O/c27-18-20-11-13-21(14-12-20)23-9-4-10-24(25-23)22-8-5-15-26(17-22)16-19-6-2-1-3-7-19/h1-4,6-7,9-14,22,27H,5,8,15-18H2.
What are the key properties of [4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol?
[4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol has a molecular weight of 358.49 g/mol, XLogP of 4.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[6-(1-benzylpiperidin-3-yl)-2-pyridinyl]phenyl]methanol is sourced from PubChem (CID 110249251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).