1-(4-methoxyphenoxy)-2-phenylpropan-2-ol

C16H18O3 — CID 62373674

IUPAC1-(4-methoxyphenoxy)-2-phenylpropan-2-ol
SMILESCOc1ccc(OCC(C)(O)c2ccccc2)cc1
InChIInChI=1S/C16H18O3/c1-16(17,13-6-4-3-5-7-13)12-19-15-10-8-14(18-2)9-11-15/h3-11,17H,12H2,1-2H3
InChIKeyDAPVWGITLGAEJF-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.98
Rot. Bonds5

About 1-(4-methoxyphenoxy)-2-phenylpropan-2-ol

1-(4-methoxyphenoxy)-2-phenylpropan-2-ol (PubChem CID 62373674) has the molecular formula C16H18O3 and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-(4-methoxyphenoxy)-2-phenylpropan-2-ol.

Molecular Properties

Compound Name1-(4-methoxyphenoxy)-2-phenylpropan-2-ol
PubChem CID62373674
Molecular FormulaC16H18O3
Molecular Weight258.32 g/mol
Exact Mass258.13
IUPAC Name1-(4-methoxyphenoxy)-2-phenylpropan-2-ol
SMILESCOc1ccc(OCC(C)(O)c2ccccc2)cc1
InChIInChI=1S/C16H18O3/c1-16(17,13-6-4-3-5-7-13)12-19-15-10-8-14(18-2)9-11-15/h3-11,17H,12H2,1-2H3
InChIKeyDAPVWGITLGAEJF-UHFFFAOYSA-N
XLogP2.98
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-methoxyphenoxy)-2-phenylpropan-2-ol 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-[4-(methylamino)phenoxy]-2-phenylpropan-2-ol
CID 62373858
1-[4-[(1S)-1-hydroxyethyl]phenoxy]-2-phenylpropan-2-ol
CID 78930168
1-[2-(hydroxymethyl)-5-methoxyphenoxy]-2-phenylpropan-2-ol
CID 62374358
1-(3-bromo-4-fluorophenoxy)-2-phenylpropan-2-ol
CID 83234065
1-(4-methoxyphenyl)-1,2,2-triphenylethane-1,2-diol
CID 70611668
3-(4-methoxyphenoxy)-2,2-dimethylpropan-1-ol
CID 11031093
1-hydroxy-1-(4-methoxyphenyl)-1-phenylpropan-2-one
CID 141100176
2-(4-methoxyanilino)-1,1-diphenylethanol
CID 101160453
1-[(2-methylpropan-2-yl)oxy]-2-phenylpropan-2-ol
CID 13140414
1-(4-methoxyphenoxy)-2-methylpropan-2-amine
CID 18349748
2-(4-methoxyphenyl)butan-2-ol
CID 10307904
1-(2-hydroxy-2-phenylpropyl)-3-[(4-methoxyphenyl)methyl]urea
CID 121112092

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenoxy)-2-phenylpropan-2-ol?
The IUPAC name of 1-(4-methoxyphenoxy)-2-phenylpropan-2-ol (CID 62373674) is 1-(4-methoxyphenoxy)-2-phenylpropan-2-ol.
What is the SMILES notation for 1-(4-methoxyphenoxy)-2-phenylpropan-2-ol?
The canonical SMILES for 1-(4-methoxyphenoxy)-2-phenylpropan-2-ol is COc1ccc(OCC(C)(O)c2ccccc2)cc1.
What is the InChIKey of 1-(4-methoxyphenoxy)-2-phenylpropan-2-ol?
The InChIKey is DAPVWGITLGAEJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O3/c1-16(17,13-6-4-3-5-7-13)12-19-15-10-8-14(18-2)9-11-15/h3-11,17H,12H2,1-2H3.
What are the key properties of 1-(4-methoxyphenoxy)-2-phenylpropan-2-ol?
1-(4-methoxyphenoxy)-2-phenylpropan-2-ol has a molecular weight of 258.32 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenoxy)-2-phenylpropan-2-ol is sourced from PubChem (CID 62373674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).