2-cyclohexyl-2,6-diphenylcyclohexan-1-ol

C24H30O — CID 130286217

IUPAC2-cyclohexyl-2,6-diphenylcyclohexan-1-ol
SMILESOC1C(c2ccccc2)CCCC1(c1ccccc1)C1CCCCC1
InChIInChI=1S/C24H30O/c25-23-22(19-11-4-1-5-12-19)17-10-18-24(23,20-13-6-2-7-14-20)21-15-8-3-9-16-21/h1-2,4-7,11-14,21-23,25H,3,8-10,15-18H2
InChIKeyHUURUTODRNQZGG-UHFFFAOYSA-N
MW334.50 g/mol
LogP5.83
Rot. Bonds3

About 2-cyclohexyl-2,6-diphenylcyclohexan-1-ol

2-cyclohexyl-2,6-diphenylcyclohexan-1-ol (PubChem CID 130286217) has the molecular formula C24H30O and a molecular weight of 334.50 g/mol. Its IUPAC name is 2-cyclohexyl-2,6-diphenylcyclohexan-1-ol.

Molecular Properties

Compound Name2-cyclohexyl-2,6-diphenylcyclohexan-1-ol
PubChem CID130286217
Molecular FormulaC24H30O
Molecular Weight334.50 g/mol
Exact Mass334.23
IUPAC Name2-cyclohexyl-2,6-diphenylcyclohexan-1-ol
SMILESOC1C(c2ccccc2)CCCC1(c1ccccc1)C1CCCCC1
InChIInChI=1S/C24H30O/c25-23-22(19-11-4-1-5-12-19)17-10-18-24(23,20-13-6-2-7-14-20)21-15-8-3-9-16-21/h1-2,4-7,11-14,21-23,25H,3,8-10,15-18H2
InChIKeyHUURUTODRNQZGG-UHFFFAOYSA-N
XLogP5.83
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.50
LogP ≤ 55.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-2,6-diphenylcyclohexan-1-ol?
The IUPAC name of 2-cyclohexyl-2,6-diphenylcyclohexan-1-ol (CID 130286217) is 2-cyclohexyl-2,6-diphenylcyclohexan-1-ol.
What is the SMILES notation for 2-cyclohexyl-2,6-diphenylcyclohexan-1-ol?
The canonical SMILES for 2-cyclohexyl-2,6-diphenylcyclohexan-1-ol is OC1C(c2ccccc2)CCCC1(c1ccccc1)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-2,6-diphenylcyclohexan-1-ol?
The InChIKey is HUURUTODRNQZGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30O/c25-23-22(19-11-4-1-5-12-19)17-10-18-24(23,20-13-6-2-7-14-20)21-15-8-3-9-16-21/h1-2,4-7,11-14,21-23,25H,3,8-10,15-18H2.
What are the key properties of 2-cyclohexyl-2,6-diphenylcyclohexan-1-ol?
2-cyclohexyl-2,6-diphenylcyclohexan-1-ol has a molecular weight of 334.50 g/mol, XLogP of 5.83, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-2,6-diphenylcyclohexan-1-ol is sourced from PubChem (CID 130286217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).