[2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol

C17H20O3 — CID 65446582

IUPAC[2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol
SMILESCOc1ccc(CCOc2ccc(C)cc2CO)cc1
InChIInChI=1S/C17H20O3/c1-13-3-8-17(15(11-13)12-18)20-10-9-14-4-6-16(19-2)7-5-14/h3-8,11,18H,9-10,12H2,1-2H3
InChIKeyXHXUSDDPVRAPGX-UHFFFAOYSA-N
MW272.34 g/mol
LogP3.12
Rot. Bonds6

About [2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol

[2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol (PubChem CID 65446582) has the molecular formula C17H20O3 and a molecular weight of 272.34 g/mol. Its IUPAC name is [2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol.

Molecular Properties

Compound Name[2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol
PubChem CID65446582
Molecular FormulaC17H20O3
Molecular Weight272.34 g/mol
Exact Mass272.14
IUPAC Name[2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol
SMILESCOc1ccc(CCOc2ccc(C)cc2CO)cc1
InChIInChI=1S/C17H20O3/c1-13-3-8-17(15(11-13)12-18)20-10-9-14-4-6-16(19-2)7-5-14/h3-8,11,18H,9-10,12H2,1-2H3
InChIKeyXHXUSDDPVRAPGX-UHFFFAOYSA-N
XLogP3.12
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.34
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol?
The IUPAC name of [2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol (CID 65446582) is [2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol.
What is the SMILES notation for [2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol?
The canonical SMILES for [2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol is COc1ccc(CCOc2ccc(C)cc2CO)cc1.
What is the InChIKey of [2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol?
The InChIKey is XHXUSDDPVRAPGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O3/c1-13-3-8-17(15(11-13)12-18)20-10-9-14-4-6-16(19-2)7-5-14/h3-8,11,18H,9-10,12H2,1-2H3.
What are the key properties of [2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol?
[2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol has a molecular weight of 272.34 g/mol, XLogP of 3.12, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol is sourced from PubChem (CID 65446582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).