4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol

C25H32O2 — CID 139824839

IUPAC4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol
SMILESOC1CCC(C(c2ccccc2)(c2ccccc2)C2CCC(O)CC2)CC1
InChIInChI=1S/C25H32O2/c26-23-15-11-21(12-16-23)25(19-7-3-1-4-8-19,20-9-5-2-6-10-20)22-13-17-24(27)18-14-22/h1-10,21-24,26-27H,11-18H2
InChIKeyJECAHPVEEZZJFT-UHFFFAOYSA-N
MW364.53 g/mol
LogP5.07
Rot. Bonds4

About 4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol

4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol (PubChem CID 139824839) has the molecular formula C25H32O2 and a molecular weight of 364.53 g/mol. Its IUPAC name is 4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol
PubChem CID139824839
Molecular FormulaC25H32O2
Molecular Weight364.53 g/mol
Exact Mass364.24
IUPAC Name4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol
SMILESOC1CCC(C(c2ccccc2)(c2ccccc2)C2CCC(O)CC2)CC1
InChIInChI=1S/C25H32O2/c26-23-15-11-21(12-16-23)25(19-7-3-1-4-8-19,20-9-5-2-6-10-20)22-13-17-24(27)18-14-22/h1-10,21-24,26-27H,11-18H2
InChIKeyJECAHPVEEZZJFT-UHFFFAOYSA-N
XLogP5.07
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.53
LogP ≤ 55.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-hydroxycyclopentyl)-2,2-diphenylacetonitrile
CID 70880451
2-[(1R,3S)-3-hydroxycyclopentyl]-2,2-diphenylacetonitrile
CID 68601434
4-(2-phenylphosphanylpropan-2-yl)cyclohexan-1-ol
CID 118047430
CID 11241556
CID 11241556
cyclopropyl-methoxy-phenylmethanol
CID 154503172
2-amino-1-cyclopropyl-1-phenylethanol
CID 71683828
1,1'-biphenyl;cyclohexanol
CID 142137438
acetylene;cyclohexane-1,4-diol;1,2-difluorobenzene
CID 144811099
2-cyclopropyl-2-hydroxy-1,2-diphenylethanone
CID 69294173
9-[cyclopentyl(diphenyl)methyl]-2,3,6,7-tetramethyl-4b,8a,9,9a-tetrahydro-4aH-fluorene
CID 140850336
4-phenylcycloheptan-1-ol
CID 86167768
(1R)-1-cyclopentyl-1-phenylethanol;sulfane
CID 158992083

Frequently Asked Questions

What is the IUPAC name of 4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol?
The IUPAC name of 4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol (CID 139824839) is 4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol.
What is the SMILES notation for 4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol?
The canonical SMILES for 4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol is OC1CCC(C(c2ccccc2)(c2ccccc2)C2CCC(O)CC2)CC1.
What is the InChIKey of 4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol?
The InChIKey is JECAHPVEEZZJFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32O2/c26-23-15-11-21(12-16-23)25(19-7-3-1-4-8-19,20-9-5-2-6-10-20)22-13-17-24(27)18-14-22/h1-10,21-24,26-27H,11-18H2.
What are the key properties of 4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol?
4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol has a molecular weight of 364.53 g/mol, XLogP of 5.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-hydroxycyclohexyl)-diphenylmethyl]cyclohexan-1-ol is sourced from PubChem (CID 139824839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).