1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol

C16H24O3 — CID 104753531

IUPAC1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol
SMILESCOc1cc(C)ccc1OCC(O)C1CCCCC1
InChIInChI=1S/C16H24O3/c1-12-8-9-15(16(10-12)18-2)19-11-14(17)13-6-4-3-5-7-13/h8-10,13-14,17H,3-7,11H2,1-2H3
InChIKeyONMVIOUYWDEEAM-UHFFFAOYSA-N
MW264.37 g/mol
LogP3.32
Rot. Bonds5

About 1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol

1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol (PubChem CID 104753531) has the molecular formula C16H24O3 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol.

Molecular Properties

Compound Name1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol
PubChem CID104753531
Molecular FormulaC16H24O3
Molecular Weight264.37 g/mol
Exact Mass264.17
IUPAC Name1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol
SMILESCOc1cc(C)ccc1OCC(O)C1CCCCC1
InChIInChI=1S/C16H24O3/c1-12-8-9-15(16(10-12)18-2)19-11-14(17)13-6-4-3-5-7-13/h8-10,13-14,17H,3-7,11H2,1-2H3
InChIKeyONMVIOUYWDEEAM-UHFFFAOYSA-N
XLogP3.32
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-2-(2-methoxy-4-methylphenoxy)ethanol
CID 63907448
1-cyclopentyl-2-(2-methoxyphenoxy)ethanol
CID 113449278
1-cyclopentyl-2-(2-methoxy-4-methylphenoxy)-N-methylethanamine
CID 104748636
1-cyclopropyl-2-(2,5-dimethylphenoxy)ethanol
CID 63907048
(2R)-3-(2-methoxy-4-methylphenoxy)propane-1,2-diol
CID 58551347
1-cyclohexyl-2-(2-methoxy-5-methylphenyl)ethane-1,2-diol
CID 103459031
1-cyclobutyl-2-(2-methoxy-5-methylphenyl)ethanol
CID 64987117
N-[2-(2-methoxy-4-methylphenoxy)ethyl]cycloheptanamine
CID 62571722
1-cyclopentyl-2-(3,5-dimethylphenoxy)ethanol
CID 113449276
1-cyclobutyl-2-(3-methylphenoxy)ethanol
CID 117245576
1-cyclopentyl-2-(2-propoxyphenoxy)ethanol
CID 104753565
1-cyclohexyl-2-(2,4-dimethylphenoxy)ethanamine
CID 104748372

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol?
The IUPAC name of 1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol (CID 104753531) is 1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol.
What is the SMILES notation for 1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol?
The canonical SMILES for 1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol is COc1cc(C)ccc1OCC(O)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol?
The InChIKey is ONMVIOUYWDEEAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O3/c1-12-8-9-15(16(10-12)18-2)19-11-14(17)13-6-4-3-5-7-13/h8-10,13-14,17H,3-7,11H2,1-2H3.
What are the key properties of 1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol?
1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol has a molecular weight of 264.37 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-(2-methoxy-4-methylphenoxy)ethanol is sourced from PubChem (CID 104753531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).