2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol

C17H26O — CID 63410724

IUPAC2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol
SMILESCc1ccc(CC(O)C2CCC(C)CC2)cc1C
InChIInChI=1S/C17H26O/c1-12-4-8-16(9-5-12)17(18)11-15-7-6-13(2)14(3)10-15/h6-7,10,12,16-18H,4-5,8-9,11H2,1-3H3
InChIKeyUQGNUQNFRZZDLG-UHFFFAOYSA-N
MW246.39 g/mol
LogP4.03
Rot. Bonds3

About 2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol

2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol (PubChem CID 63410724) has the molecular formula C17H26O and a molecular weight of 246.39 g/mol. Its IUPAC name is 2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol.

Molecular Properties

Compound Name2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol
PubChem CID63410724
Molecular FormulaC17H26O
Molecular Weight246.39 g/mol
Exact Mass246.20
IUPAC Name2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol
SMILESCc1ccc(CC(O)C2CCC(C)CC2)cc1C
InChIInChI=1S/C17H26O/c1-12-4-8-16(9-5-12)17(18)11-15-7-6-13(2)14(3)10-15/h6-7,10,12,16-18H,4-5,8-9,11H2,1-3H3
InChIKeyUQGNUQNFRZZDLG-UHFFFAOYSA-N
XLogP4.03
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.39
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanamine
CID 63415430
2-(3-bromo-4-methylphenyl)-1-cyclopropylethanol
CID 130608339
2-(4-ethylphenyl)-1-(4-methylcyclohexyl)ethanol
CID 63410677
2-(3-bromophenyl)-1-(4-methylcyclohexyl)ethanol
CID 63411098
1-cyclopropyl-4-(3,4-dimethylphenyl)butan-1-ol
CID 64515372
(1R)-1-cyclopropyl-2-(4-methylphenyl)ethanol
CID 39236667
1-cyclopropyl-3-(3,4-dimethylphenyl)-1-methoxypropan-2-ol
CID 116712521
2-(3-bromo-4-methoxyphenyl)-1-(3-methylcyclopentyl)ethanol
CID 65401348
1-(3,3-dimethylbutan-2-yl)-4-methylcyclohexane;4-(2,2-dimethylpropyl)-1,2-dimethylbenzene
CID 162223528
1-(2-bicyclo[2.2.1]heptanyl)-2-(3,4-dimethylphenyl)ethanol
CID 63017843
2-(2-methoxy-5-methylphenyl)-1-(4-methylcyclohexyl)ethanol
CID 62159658
1-cyclopropyl-2-(2,5-dimethylphenyl)ethanol
CID 61481966

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol?
The IUPAC name of 2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol (CID 63410724) is 2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol.
What is the SMILES notation for 2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol?
The canonical SMILES for 2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol is Cc1ccc(CC(O)C2CCC(C)CC2)cc1C.
What is the InChIKey of 2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol?
The InChIKey is UQGNUQNFRZZDLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O/c1-12-4-8-16(9-5-12)17(18)11-15-7-6-13(2)14(3)10-15/h6-7,10,12,16-18H,4-5,8-9,11H2,1-3H3.
What are the key properties of 2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol?
2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol has a molecular weight of 246.39 g/mol, XLogP of 4.03, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylphenyl)-1-(4-methylcyclohexyl)ethanol is sourced from PubChem (CID 63410724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).