[2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol

C16H24O2 — CID 112612421

IUPAC[2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol
SMILESCc1cccc(CO)c1OC1CC(C)CC(C)C1
InChIInChI=1S/C16H24O2/c1-11-7-12(2)9-15(8-11)18-16-13(3)5-4-6-14(16)10-17/h4-6,11-12,15,17H,7-10H2,1-3H3
InChIKeyFOXPIYRCTVDLEO-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.69
Rot. Bonds3

About [2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol

[2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol (PubChem CID 112612421) has the molecular formula C16H24O2 and a molecular weight of 248.37 g/mol. Its IUPAC name is [2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol.

Molecular Properties

Compound Name[2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol
PubChem CID112612421
Molecular FormulaC16H24O2
Molecular Weight248.37 g/mol
Exact Mass248.18
IUPAC Name[2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol
SMILESCc1cccc(CO)c1OC1CC(C)CC(C)C1
InChIInChI=1S/C16H24O2/c1-11-7-12(2)9-15(8-11)18-16-13(3)5-4-6-14(16)10-17/h4-6,11-12,15,17H,7-10H2,1-3H3
InChIKeyFOXPIYRCTVDLEO-UHFFFAOYSA-N
XLogP3.69
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methyl]cyclopropanamine
CID 115953881
[3-methyl-2-(oxan-4-yloxy)phenyl]methanol
CID 112612396
N-[[2-(3,4-dimethylcyclohexyl)oxy-3-methylphenyl]methyl]ethanamine
CID 115952581
[5-bromo-2-(3,5-dimethylcyclohexyl)oxyphenyl]methanol
CID 64735922
(2-decoxy-3-methylphenyl)methanol
CID 115956202
[2-[2-(dimethylamino)ethoxy]-3-methylphenyl]methanol
CID 112612503
N-[[3-chloro-2-(3,5-dimethylcyclohexyl)oxyphenyl]methyl]cyclopropanamine
CID 115953723
[1-(3,5-dimethylcyclohexyl)oxyisoquinolin-3-yl]methanol
CID 64728619
1-bromo-3-methyl-2-[(1R,3S)-3-methylcyclopentyl]oxybenzene
CID 170070358
[2-(3-ethylcyclohexyl)oxy-3-methylphenyl]methanamine
CID 112607468
3-(2,6-dimethylphenoxy)-N-ethylcyclobutan-1-amine
CID 66358499
3-[2-(hydroxymethyl)-6-methylphenoxy]butan-2-ol
CID 112612422

Frequently Asked Questions

What is the IUPAC name of [2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol?
The IUPAC name of [2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol (CID 112612421) is [2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol.
What is the SMILES notation for [2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol?
The canonical SMILES for [2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol is Cc1cccc(CO)c1OC1CC(C)CC(C)C1.
What is the InChIKey of [2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol?
The InChIKey is FOXPIYRCTVDLEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O2/c1-11-7-12(2)9-15(8-11)18-16-13(3)5-4-6-14(16)10-17/h4-6,11-12,15,17H,7-10H2,1-3H3.
What are the key properties of [2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol?
[2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol has a molecular weight of 248.37 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,5-dimethylcyclohexyl)oxy-3-methylphenyl]methanol is sourced from PubChem (CID 112612421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).