2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol

C18H22O3 — CID 103433262

IUPAC2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol
SMILESCOc1c(C(O)C(OC)c2ccccc2)ccc(C)c1C
InChIInChI=1S/C18H22O3/c1-12-10-11-15(17(20-3)13(12)2)16(19)18(21-4)14-8-6-5-7-9-14/h5-11,16,18-19H,1-4H3
InChIKeyQLIGJSATDRGMEM-UHFFFAOYSA-N
MW286.37 g/mol
LogP3.73
Rot. Bonds5

About 2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol

2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol (PubChem CID 103433262) has the molecular formula C18H22O3 and a molecular weight of 286.37 g/mol. Its IUPAC name is 2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol.

Molecular Properties

Compound Name2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol
PubChem CID103433262
Molecular FormulaC18H22O3
Molecular Weight286.37 g/mol
Exact Mass286.16
IUPAC Name2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol
SMILESCOc1c(C(O)C(OC)c2ccccc2)ccc(C)c1C
InChIInChI=1S/C18H22O3/c1-12-10-11-15(17(20-3)13(12)2)16(19)18(21-4)14-8-6-5-7-9-14/h5-11,16,18-19H,1-4H3
InChIKeyQLIGJSATDRGMEM-UHFFFAOYSA-N
XLogP3.73
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol
CID 116756761
[3-(difluoromethyl)phenyl]-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103432669
1-(2-methoxy-3,4-dimethylphenyl)-2,2-dimethylpropan-1-ol
CID 103432558
2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol
CID 106680320
1-(2-ethoxyphenyl)-2-methoxy-2-phenylethanol
CID 116757008
1-(2-methoxy-3,4-dimethylphenyl)-2-methylsulfanylethanol
CID 103433114
2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-methylpropan-1-ol
CID 103433183
1-(2-methoxy-3,4-dimethylphenyl)-2-(2-methoxyphenyl)ethanol
CID 103433092
(2-fluoro-3-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103435754
(3,5-dibromophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 107978788
(2-methoxy-3,4-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanol
CID 103435788
(2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103432506

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol?
The IUPAC name of 2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol (CID 103433262) is 2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol.
What is the SMILES notation for 2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol?
The canonical SMILES for 2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol is COc1c(C(O)C(OC)c2ccccc2)ccc(C)c1C.
What is the InChIKey of 2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol?
The InChIKey is QLIGJSATDRGMEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O3/c1-12-10-11-15(17(20-3)13(12)2)16(19)18(21-4)14-8-6-5-7-9-14/h5-11,16,18-19H,1-4H3.
What are the key properties of 2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol?
2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol has a molecular weight of 286.37 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol is sourced from PubChem (CID 103433262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).