2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide

C23H19NO3 — CID 155812175

IUPAC2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide
SMILESO=C(Cc1ccc(/C=C/C(=O)c2ccccc2O)cc1)Nc1ccccc1
InChIInChI=1S/C23H19NO3/c25-21-9-5-4-8-20(21)22(26)15-14-17-10-12-18(13-11-17)16-23(27)24-19-6-2-1-3-7-19/h1-15,25H,16H2,(H,24,27)/b15-14+
InChIKeyODKSNQDOJRXOMB-CCEZHUSRSA-N
MW357.41 g/mol
LogP4.47
Rot. Bonds6

About 2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide

2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide (PubChem CID 155812175) has the molecular formula C23H19NO3 and a molecular weight of 357.41 g/mol. Its IUPAC name is 2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide.

Molecular Properties

Compound Name2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide
PubChem CID155812175
Molecular FormulaC23H19NO3
Molecular Weight357.41 g/mol
Exact Mass357.14
IUPAC Name2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide
SMILESO=C(Cc1ccc(/C=C/C(=O)c2ccccc2O)cc1)Nc1ccccc1
InChIInChI=1S/C23H19NO3/c25-21-9-5-4-8-20(21)22(26)15-14-17-10-12-18(13-11-17)16-23(27)24-19-6-2-1-3-7-19/h1-15,25H,16H2,(H,24,27)/b15-14+
InChIKeyODKSNQDOJRXOMB-CCEZHUSRSA-N
XLogP4.47
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide 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-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide?
The IUPAC name of 2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide (CID 155812175) is 2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide.
What is the SMILES notation for 2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide?
The canonical SMILES for 2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide is O=C(Cc1ccc(/C=C/C(=O)c2ccccc2O)cc1)Nc1ccccc1.
What is the InChIKey of 2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide?
The InChIKey is ODKSNQDOJRXOMB-CCEZHUSRSA-N. The full InChI is InChI=1S/C23H19NO3/c25-21-9-5-4-8-20(21)22(26)15-14-17-10-12-18(13-11-17)16-23(27)24-19-6-2-1-3-7-19/h1-15,25H,16H2,(H,24,27)/b15-14+.
What are the key properties of 2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide?
2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide has a molecular weight of 357.41 g/mol, XLogP of 4.47, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]phenyl]-N-phenylacetamide is sourced from PubChem (CID 155812175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).