1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol

C17H26O — CID 63863084

IUPAC1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol
SMILESCCC1CCCCC1C(O)Cc1cccc(C)c1
InChIInChI=1S/C17H26O/c1-3-15-9-4-5-10-16(15)17(18)12-14-8-6-7-13(2)11-14/h6-8,11,15-18H,3-5,9-10,12H2,1-2H3
InChIKeyJROZETOAZJXNQT-UHFFFAOYSA-N
MW246.39 g/mol
LogP4.11
Rot. Bonds4

About 1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol

1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol (PubChem CID 63863084) has the molecular formula C17H26O and a molecular weight of 246.39 g/mol. Its IUPAC name is 1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol.

Molecular Properties

Compound Name1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol
PubChem CID63863084
Molecular FormulaC17H26O
Molecular Weight246.39 g/mol
Exact Mass246.20
IUPAC Name1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol
SMILESCCC1CCCCC1C(O)Cc1cccc(C)c1
InChIInChI=1S/C17H26O/c1-3-15-9-4-5-10-16(15)17(18)12-14-8-6-7-13(2)11-14/h6-8,11,15-18H,3-5,9-10,12H2,1-2H3
InChIKeyJROZETOAZJXNQT-UHFFFAOYSA-N
XLogP4.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.39
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclohexyl-2-(3-methylphenyl)ethanol
CID 60798994
1-(2-ethylcyclohexyl)-3-(3-methylphenyl)propan-1-amine
CID 105151295
1-(2-ethylcyclohexyl)-N-methyl-3-(3-methylphenyl)propan-1-amine
CID 105151232
2-(3-methylphenyl)-1-(4-propan-2-ylcyclohexyl)ethanol
CID 65424884
4-cyclopentyl-1-(3-methylphenyl)butan-2-ol
CID 55149919
2-(3-methylphenyl)-1-piperidin-3-ylethanol
CID 79019455
2-(3-methylphenyl)-1-(oxolan-3-yl)ethanol
CID 63018675
2-(2-ethylcyclohexyl)-3-(3-fluorophenyl)propanoic acid
CID 79418399
3-methyl-4-(3-methylphenyl)butan-2-ol
CID 22157927
1-(4-cyclobutylphenyl)-2-(3-methylphenyl)ethanol
CID 116505746
1-(2-chloro-2-cyclopropylethyl)-3-methylbenzene
CID 63017026
1-cyclopropyl-2-(3-methylphenyl)ethanamine
CID 54594185

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol?
The IUPAC name of 1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol (CID 63863084) is 1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol.
What is the SMILES notation for 1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol?
The canonical SMILES for 1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol is CCC1CCCCC1C(O)Cc1cccc(C)c1.
What is the InChIKey of 1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol?
The InChIKey is JROZETOAZJXNQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O/c1-3-15-9-4-5-10-16(15)17(18)12-14-8-6-7-13(2)11-14/h6-8,11,15-18H,3-5,9-10,12H2,1-2H3.
What are the key properties of 1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol?
1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol has a molecular weight of 246.39 g/mol, XLogP of 4.11, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylcyclohexyl)-2-(3-methylphenyl)ethanol is sourced from PubChem (CID 63863084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).