1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride

C25H34ClNO — CID 11972073

IUPAC1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride
SMILESCl.OC(c1ccccc1)(C1CCCCC1)C(c1ccccc1)N1CCCCC1
InChIInChI=1S/C25H33NO.ClH/c27-25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24(21-13-5-1-6-14-21)26-19-11-4-12-20-26;/h1-2,5-8,13-16,23-24,27H,3-4,9-12,17-20H2;1H
InChIKeyUWJKSYHLPOPZPL-UHFFFAOYSA-N
MW400.01 g/mol
LogP6.10
Rot. Bonds5

About 1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride

1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride (PubChem CID 11972073) has the molecular formula C25H34ClNO and a molecular weight of 400.01 g/mol. Its IUPAC name is 1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride.

Molecular Properties

Compound Name1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride
PubChem CID11972073
Molecular FormulaC25H34ClNO
Molecular Weight400.01 g/mol
Exact Mass399.23
IUPAC Name1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride
SMILESCl.OC(c1ccccc1)(C1CCCCC1)C(c1ccccc1)N1CCCCC1
InChIInChI=1S/C25H33NO.ClH/c27-25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24(21-13-5-1-6-14-21)26-19-11-4-12-20-26;/h1-2,5-8,13-16,23-24,27H,3-4,9-12,17-20H2;1H
InChIKeyUWJKSYHLPOPZPL-UHFFFAOYSA-N
XLogP6.10
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.01
LogP ≤ 56.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S,2R)-1-cyclohexyl-2-(4-methylpiperazin-1-yl)-1-phenylpropan-1-ol
CID 92573539
1-cyclohexyl-3-morpholin-4-yl-1,2-diphenylpropan-1-ol
CID 23604846
1-[(1S)-2,2-dimethyl-1-phenylpropyl]pyrrolidine
CID 59470641
1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine
CID 43829706
1-cyclohexyl-4-(2-methyl-1,2-diphenylpropyl)piperazine
CID 71410535
1-(4-bromophenyl)-1-cyclohexyl-3-morpholin-4-yl-2-phenylpropan-1-ol;hydrochloride
CID 25112706
(1S)-1-cyclopentyl-1-phenyl-3-piperidin-1-ylpropan-1-ol;hydrochloride
CID 46878511
(2S)-2-(4-methylpiperazin-1-yl)-1,1,2-triphenylethanol
CID 24781288
(1R,2R)-1-(4-bromophenyl)-1-cyclohexyl-3-morpholin-4-yl-2-phenylpropan-1-ol
CID 92720766
1-cyclohexyl-1-phenyl-5-piperidin-1-ylpent-3-yn-1-ol
CID 2835415
4-(azepan-1-yl)-1-cyclopentyl-1-phenylbut-2-yn-1-ol;hydrochloride
CID 2915878
dicyclohexyl-[(2S)-1-[(1R)-1-phenylethyl]azetidin-2-yl]methanol
CID 124865263

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride?
The IUPAC name of 1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride (CID 11972073) is 1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride.
What is the SMILES notation for 1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride?
The canonical SMILES for 1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride is Cl.OC(c1ccccc1)(C1CCCCC1)C(c1ccccc1)N1CCCCC1.
What is the InChIKey of 1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride?
The InChIKey is UWJKSYHLPOPZPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H33NO.ClH/c27-25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24(21-13-5-1-6-14-21)26-19-11-4-12-20-26;/h1-2,5-8,13-16,23-24,27H,3-4,9-12,17-20H2;1H.
What are the key properties of 1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride?
1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride has a molecular weight of 400.01 g/mol, XLogP of 6.10, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1,2-diphenyl-2-piperidin-1-ylethanol;hydrochloride is sourced from PubChem (CID 11972073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).