1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone

C16H16O3 — CID 22096604

IUPAC1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone
SMILESCCOc1ccccc1C(=O)C(O)c1ccccc1
InChIInChI=1S/C16H16O3/c1-2-19-14-11-7-6-10-13(14)16(18)15(17)12-8-4-3-5-9-12/h3-11,15,17H,2H2,1H3
InChIKeyDLUPHJKQEIIYAM-UHFFFAOYSA-N
MW256.30 g/mol
LogP3.00
Rot. Bonds5

About 1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone

1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone (PubChem CID 22096604) has the molecular formula C16H16O3 and a molecular weight of 256.30 g/mol. Its IUPAC name is 1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone.

Molecular Properties

Compound Name1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone
PubChem CID22096604
Molecular FormulaC16H16O3
Molecular Weight256.30 g/mol
Exact Mass256.11
IUPAC Name1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone
SMILESCCOc1ccccc1C(=O)C(O)c1ccccc1
InChIInChI=1S/C16H16O3/c1-2-19-14-11-7-6-10-13(14)16(18)15(17)12-8-4-3-5-9-12/h3-11,15,17H,2H2,1H3
InChIKeyDLUPHJKQEIIYAM-UHFFFAOYSA-N
XLogP3.00
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone 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-(2-ethoxyphenyl)-2-phenylbutan-1-one
CID 114971123
1-(2-ethoxyphenyl)-2-methylpropan-1-one
CID 62800406
2-ethoxybenzoic acid;zinc
CID 172723273
1-(2-ethoxyphenyl)-3-ethyl-2-hydroxypentan-1-one
CID 103458596
2-amino-1-(2-ethoxyphenyl)butan-1-one
CID 116583912
potassium;2-ethoxybenzoic acid;hydride
CID 175278645
2-ethoxybenzoyl bromide
CID 19426336
2-ethoxybenzenecarboperoxoic acid
CID 22314606
3-(2-ethoxyphenyl)-3-oxopropanoic acid
CID 170886850
1-(2-ethoxyphenyl)-2-methoxy-3-methylbutan-1-one
CID 116708332
1-(2-ethoxyphenyl)-2-pyridin-4-ylpropan-1-one
CID 66469435
2-[[1-(2-ethoxyphenyl)-1-oxopropan-2-yl]amino]acetic acid
CID 82101024

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone?
The IUPAC name of 1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone (CID 22096604) is 1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone.
What is the SMILES notation for 1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone?
The canonical SMILES for 1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone is CCOc1ccccc1C(=O)C(O)c1ccccc1.
What is the InChIKey of 1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone?
The InChIKey is DLUPHJKQEIIYAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O3/c1-2-19-14-11-7-6-10-13(14)16(18)15(17)12-8-4-3-5-9-12/h3-11,15,17H,2H2,1H3.
What are the key properties of 1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone?
1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone has a molecular weight of 256.30 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone is sourced from PubChem (CID 22096604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).