4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol

C25H33NO2 — CID 15233109

IUPAC4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol
SMILESCOc1ccc(C2(O)CCC(N3CCC(Cc4ccccc4)CC3)CC2)cc1
InChIInChI=1S/C25H33NO2/c1-28-24-9-7-22(8-10-24)25(27)15-11-23(12-16-25)26-17-13-21(14-18-26)19-20-5-3-2-4-6-20/h2-10,21,23,27H,11-19H2,1H3
InChIKeyAYAPPYTZEFHPLI-UHFFFAOYSA-N
MW379.54 g/mol
LogP4.78
Rot. Bonds5

About 4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol

4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol (PubChem CID 15233109) has the molecular formula C25H33NO2 and a molecular weight of 379.54 g/mol. Its IUPAC name is 4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol
PubChem CID15233109
Molecular FormulaC25H33NO2
Molecular Weight379.54 g/mol
Exact Mass379.25
IUPAC Name4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol
SMILESCOc1ccc(C2(O)CCC(N3CCC(Cc4ccccc4)CC3)CC2)cc1
InChIInChI=1S/C25H33NO2/c1-28-24-9-7-22(8-10-24)25(27)15-11-23(12-16-25)26-17-13-21(14-18-26)19-20-5-3-2-4-6-20/h2-10,21,23,27H,11-19H2,1H3
InChIKeyAYAPPYTZEFHPLI-UHFFFAOYSA-N
XLogP4.78
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.54
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[4-(4-benzylpiperidine-1-carbonyl)piperidin-1-yl]-N-(4-methoxyphenyl)piperidine-1-carboxamide
CID 42693679
N-(4-hydroxy-4-phenylcyclohexyl)-4-[(3-methoxyphenyl)methyl]piperidine-1-carboxamide
CID 154861617
(1R,5S)-8-benzyl-3-(4-methoxyphenyl)-8-azabicyclo[3.2.1]octan-3-ol
CID 13091234
1-(4-benzylpiperidin-1-yl)-2-(4-methoxyphenyl)propan-1-ol
CID 159181965
1-hydroxy-4-[(4-methoxyphenyl)methyl]piperidine
CID 122445485
4-(4-benzylpiperidin-1-yl)cyclohexan-1-amine
CID 62806898
4-(4-benzylpiperazin-1-yl)-1-(4-fluorophenyl)cyclohexan-1-ol
CID 22122113
1-(4-benzylpiperidin-1-yl)-2-(4-methoxyphenoxy)ethanone
CID 740892
(3R)-1-benzyl-3-(4-methoxyphenyl)piperidin-3-ol
CID 92976626
ethane;4-(3-methylpyrrolidin-1-yl)-1-phenylcyclohexan-1-ol
CID 91168784
1-(cyclopropylmethyl)-4-methoxybenzene
CID 6422476
(1-hydroxycyclopentyl)-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]methanone
CID 110912966

Frequently Asked Questions

What is the IUPAC name of 4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol?
The IUPAC name of 4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol (CID 15233109) is 4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol.
What is the SMILES notation for 4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol?
The canonical SMILES for 4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol is COc1ccc(C2(O)CCC(N3CCC(Cc4ccccc4)CC3)CC2)cc1.
What is the InChIKey of 4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol?
The InChIKey is AYAPPYTZEFHPLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H33NO2/c1-28-24-9-7-22(8-10-24)25(27)15-11-23(12-16-25)26-17-13-21(14-18-26)19-20-5-3-2-4-6-20/h2-10,21,23,27H,11-19H2,1H3.
What are the key properties of 4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol?
4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol has a molecular weight of 379.54 g/mol, XLogP of 4.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-benzylpiperidin-1-yl)-1-(4-methoxyphenyl)cyclohexan-1-ol is sourced from PubChem (CID 15233109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).