(3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol

C17H26O — CID 63895871

IUPAC(3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol
SMILESCCC1CCCCC1C(O)c1ccc(C)c(C)c1
InChIInChI=1S/C17H26O/c1-4-14-7-5-6-8-16(14)17(18)15-10-9-12(2)13(3)11-15/h9-11,14,16-18H,4-8H2,1-3H3
InChIKeyBMCBAHSJSDBUGJ-UHFFFAOYSA-N
MW246.39 g/mol
LogP4.55
Rot. Bonds3

About (3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol

(3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol (PubChem CID 63895871) has the molecular formula C17H26O and a molecular weight of 246.39 g/mol. Its IUPAC name is (3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol.

Molecular Properties

Compound Name(3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol
PubChem CID63895871
Molecular FormulaC17H26O
Molecular Weight246.39 g/mol
Exact Mass246.20
IUPAC Name(3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol
SMILESCCC1CCCCC1C(O)c1ccc(C)c(C)c1
InChIInChI=1S/C17H26O/c1-4-14-7-5-6-8-16(14)17(18)15-10-9-12(2)13(3)11-15/h9-11,14,16-18H,4-8H2,1-3H3
InChIKeyBMCBAHSJSDBUGJ-UHFFFAOYSA-N
XLogP4.55
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 ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-ethylcyclohexyl)-(4-methoxy-3-methylphenyl)methanol
CID 63893975
(2-ethylcyclohexyl)-(4-methylsulfanylphenyl)methanol
CID 115801687
[4-bromo-3-(trifluoromethyl)phenyl]-(2-ethylcyclohexyl)methanol
CID 115801665
(2-ethylcyclohexyl)-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methanol
CID 63893497
(2-ethylcyclohexyl)-pyrimidin-5-ylmethanol
CID 102924025
(R)-(2-ethylcyclopentyl)-(2-methylphenyl)methanol
CID 59207149
N-[(4-chloro-3-methylphenyl)-(2-ethylcyclohexyl)methyl]propan-1-amine
CID 115862665
(2-ethylcyclohexyl)-(furan-2-yl)methanol
CID 63861285
(2-aminophenyl)-(2-ethylcyclohexyl)methanol
CID 64831996
(2-chloro-4-fluorophenyl)-(2-ethylcyclohexyl)methanol
CID 63861648
1-(3,4-dimethylphenyl)-3-(2-ethylpiperidin-1-yl)propan-1-ol
CID 82073504
cyclohex-3-en-1-yl-(3,4-dimethylphenyl)methanol
CID 63900775

Frequently Asked Questions

What is the IUPAC name of (3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol?
The IUPAC name of (3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol (CID 63895871) is (3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol.
What is the SMILES notation for (3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol?
The canonical SMILES for (3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol is CCC1CCCCC1C(O)c1ccc(C)c(C)c1.
What is the InChIKey of (3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol?
The InChIKey is BMCBAHSJSDBUGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O/c1-4-14-7-5-6-8-16(14)17(18)15-10-9-12(2)13(3)11-15/h9-11,14,16-18H,4-8H2,1-3H3.
What are the key properties of (3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol?
(3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol has a molecular weight of 246.39 g/mol, XLogP of 4.55, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dimethylphenyl)-(2-ethylcyclohexyl)methanol is sourced from PubChem (CID 63895871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).