2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone

C15H14O3 — CID 161011809

IUPAC2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone
SMILESO=C(Cc1ccc(CO)cc1)c1ccccc1O
InChIInChI=1S/C15H14O3/c16-10-12-7-5-11(6-8-12)9-15(18)13-3-1-2-4-14(13)17/h1-8,16-17H,9-10H2
InChIKeyPPNCVMDQCKFMBM-UHFFFAOYSA-N
MW242.27 g/mol
LogP2.31
Rot. Bonds4

About 2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone

2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone (PubChem CID 161011809) has the molecular formula C15H14O3 and a molecular weight of 242.27 g/mol. Its IUPAC name is 2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone.

Molecular Properties

Compound Name2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone
PubChem CID161011809
Molecular FormulaC15H14O3
Molecular Weight242.27 g/mol
Exact Mass242.09
IUPAC Name2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone
SMILESO=C(Cc1ccc(CO)cc1)c1ccccc1O
InChIInChI=1S/C15H14O3/c16-10-12-7-5-11(6-8-12)9-15(18)13-3-1-2-4-14(13)17/h1-8,16-17H,9-10H2
InChIKeyPPNCVMDQCKFMBM-UHFFFAOYSA-N
XLogP2.31
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone 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

2-(4-bromophenyl)-1-(2-hydroxyphenyl)ethanone
CID 118516182
1-[2-hydroxy-4-(hydroxymethyl)phenyl]-2-[4-(hydroxymethyl)phenyl]ethanone
CID 58402413
4-[2-(2-hydroxyphenyl)-2-oxoethyl]benzonitrile
CID 148916295
1,4-bis(2-hydroxyphenyl)butane-1,4-dione
CID 3624355
2-[2-[4-(2-hydroxyacetyl)phenyl]acetyl]benzoic acid
CID 148651840
2-[2-(2-hydroxyphenyl)-2-oxoethyl]benzoic acid
CID 10729737
N-cyclohexyl-4-[2-(2-hydroxyphenyl)-2-oxoethyl]benzamide
CID 158685330
1-(2-hydroxyphenyl)-2-(2H-tetrazol-5-yl)ethanone
CID 902451
2-[2-[3-(hydroxymethyl)phenyl]acetyl]benzoic acid
CID 153222498
[4-[2-oxo-2-[2-tris[2-[2-(4-boronophenyl)acetyl]phenyl]silylphenyl]ethyl]phenyl]boronic acid
CID 87079038
2-naphthalen-2-yl-1-(2,3,4-trihydroxyphenyl)ethanone
CID 102033077
sodium 2-[4-(hydroxymethyl)phenyl]acetate
CID 139632629

Frequently Asked Questions

What is the IUPAC name of 2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone?
The IUPAC name of 2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone (CID 161011809) is 2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone.
What is the SMILES notation for 2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone?
The canonical SMILES for 2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone is O=C(Cc1ccc(CO)cc1)c1ccccc1O.
What is the InChIKey of 2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone?
The InChIKey is PPNCVMDQCKFMBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O3/c16-10-12-7-5-11(6-8-12)9-15(18)13-3-1-2-4-14(13)17/h1-8,16-17H,9-10H2.
What are the key properties of 2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone?
2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone has a molecular weight of 242.27 g/mol, XLogP of 2.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(hydroxymethyl)phenyl]-1-(2-hydroxyphenyl)ethanone is sourced from PubChem (CID 161011809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).