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

C16H24O3 — CID 116756367

IUPAC2-cyclohexyl-2-methoxy-1-(4-methoxyphenyl)ethanol
SMILESCOc1ccc(C(O)C(OC)C2CCCCC2)cc1
InChIInChI=1S/C16H24O3/c1-18-14-10-8-12(9-11-14)15(17)16(19-2)13-6-4-3-5-7-13/h8-11,13,15-17H,3-7H2,1-2H3
InChIKeyFNGHPOIYZQGSBE-UHFFFAOYSA-N
MW264.37 g/mol
LogP3.32
Rot. Bonds5

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

2-cyclohexyl-2-methoxy-1-(4-methoxyphenyl)ethanol (PubChem CID 116756367) has the molecular formula C16H24O3 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-cyclohexyl-2-methoxy-1-(4-methoxyphenyl)ethanol.

Molecular Properties

Compound Name2-cyclohexyl-2-methoxy-1-(4-methoxyphenyl)ethanol
PubChem CID116756367
Molecular FormulaC16H24O3
Molecular Weight264.37 g/mol
Exact Mass264.17
IUPAC Name2-cyclohexyl-2-methoxy-1-(4-methoxyphenyl)ethanol
SMILESCOc1ccc(C(O)C(OC)C2CCCCC2)cc1
InChIInChI=1S/C16H24O3/c1-18-14-10-8-12(9-11-14)15(17)16(19-2)13-6-4-3-5-7-13/h8-11,13,15-17H,3-7H2,1-2H3
InChIKeyFNGHPOIYZQGSBE-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

(1S,2R)-2-amino-1-cyclohexyl-2-(4-methoxyphenyl)ethanol;hydrochloride
CID 171160552
2-cyclopropyl-2-methoxy-1-(3-methoxyphenyl)ethanol
CID 116712494
3-amino-1-cycloheptyl-2-(4-methoxyphenyl)propan-1-ol
CID 65185399
3-amino-1-cyclohexyl-2-(4-methoxyphenyl)propan-1-ol;hydrochloride
CID 75106370
N-[1-(4-methoxyphenyl)ethyl]cyclohexanamine
CID 43189950
3-amino-1-cyclopentyl-2-(4-methoxyphenyl)propan-1-ol
CID 65185701
(2S,3R)-N-cyclopentyl-3-hydroxy-3-(4-methoxyphenyl)-2-methylpropanamide
CID 96538154
2-cyclohexyl-2-methoxy-1-naphthalen-1-ylethanol
CID 116756473
[cyclohexyl-(4-methoxyphenyl)methyl]hydrazine
CID 105190838
[2-cyclohexyl-2-ethoxy-1-(4-methoxyphenyl)ethyl]hydrazine
CID 105278873
2-cyclopropyl-1-(3,4-difluorophenyl)-2-methoxyethanol
CID 116712647
2-cyclohexyl-1-(2,3-dimethylphenyl)-2-methoxyethanol
CID 116756467

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-2-methoxy-1-(4-methoxyphenyl)ethanol?
The IUPAC name of 2-cyclohexyl-2-methoxy-1-(4-methoxyphenyl)ethanol (CID 116756367) is 2-cyclohexyl-2-methoxy-1-(4-methoxyphenyl)ethanol.
What is the SMILES notation for 2-cyclohexyl-2-methoxy-1-(4-methoxyphenyl)ethanol?
The canonical SMILES for 2-cyclohexyl-2-methoxy-1-(4-methoxyphenyl)ethanol is COc1ccc(C(O)C(OC)C2CCCCC2)cc1.
What is the InChIKey of 2-cyclohexyl-2-methoxy-1-(4-methoxyphenyl)ethanol?
The InChIKey is FNGHPOIYZQGSBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O3/c1-18-14-10-8-12(9-11-14)15(17)16(19-2)13-6-4-3-5-7-13/h8-11,13,15-17H,3-7H2,1-2H3.
What are the key properties of 2-cyclohexyl-2-methoxy-1-(4-methoxyphenyl)ethanol?
2-cyclohexyl-2-methoxy-1-(4-methoxyphenyl)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 2-cyclohexyl-2-methoxy-1-(4-methoxyphenyl)ethanol is sourced from PubChem (CID 116756367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).