1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol

C17H19BrO3 — CID 65434708

IUPAC1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1CC(O)c1cc(Br)c(C)cc1OC
InChIInChI=1S/C17H19BrO3/c1-11-8-17(21-3)13(10-14(11)18)15(19)9-12-6-4-5-7-16(12)20-2/h4-8,10,15,19H,9H2,1-3H3
InChIKeyGOJNOGGZLYTOBT-UHFFFAOYSA-N
MW351.24 g/mol
LogP4.05
Rot. Bonds5

About 1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol

1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol (PubChem CID 65434708) has the molecular formula C17H19BrO3 and a molecular weight of 351.24 g/mol. Its IUPAC name is 1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol
PubChem CID65434708
Molecular FormulaC17H19BrO3
Molecular Weight351.24 g/mol
Exact Mass350.05
IUPAC Name1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1CC(O)c1cc(Br)c(C)cc1OC
InChIInChI=1S/C17H19BrO3/c1-11-8-17(21-3)13(10-14(11)18)15(19)9-12-6-4-5-7-16(12)20-2/h4-8,10,15,19H,9H2,1-3H3
InChIKeyGOJNOGGZLYTOBT-UHFFFAOYSA-N
XLogP4.05
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.24
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(5-bromo-2-methoxy-4-methylphenyl)-2-(4-methoxyphenyl)ethanol
CID 65434522
(5-bromo-2-methoxy-4-methylphenyl)-(2-methylphenyl)methanol
CID 65432012
1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol
CID 62790475
2-(2-bromophenyl)-1-(2-methoxy-4-methylphenyl)ethanol
CID 106790626
2-(2-methoxyphenyl)-1-(4-methyl-3-pyridinyl)ethanol
CID 66272470
1-(5-bromo-2-methoxy-4-methylphenyl)decan-1-ol
CID 65433754
1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol
CID 61087046
1-(2-methoxy-3,4-dimethylphenyl)-2-(2-methoxyphenyl)ethanol
CID 103433092
1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-fluorophenyl)ethanamine
CID 65440683
1-(2,6-dimethoxyphenyl)-2-(2-methoxyphenyl)ethanol
CID 63018829
1-(3,5-dichlorophenyl)-2-(2-methoxyphenyl)ethanol
CID 63016213
1-(5-chloro-2-fluorophenyl)-2-(2-methoxyphenyl)ethanol
CID 55151769

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol?
The IUPAC name of 1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol (CID 65434708) is 1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol?
The canonical SMILES for 1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol is COc1ccccc1CC(O)c1cc(Br)c(C)cc1OC.
What is the InChIKey of 1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol?
The InChIKey is GOJNOGGZLYTOBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19BrO3/c1-11-8-17(21-3)13(10-14(11)18)15(19)9-12-6-4-5-7-16(12)20-2/h4-8,10,15,19H,9H2,1-3H3.
What are the key properties of 1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol?
1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol has a molecular weight of 351.24 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol is sourced from PubChem (CID 65434708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).