4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one

C22H19N3O3 — CID 9327531

IUPAC4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one
SMILESO=C1CN(C(=O)CNc2ccccc2Oc2ccccc2)c2ccccc2N1
InChIInChI=1S/C22H19N3O3/c26-21-15-25(19-12-6-4-10-17(19)24-21)22(27)14-23-18-11-5-7-13-20(18)28-16-8-2-1-3-9-16/h1-13,23H,14-15H2,(H,24,26)
InChIKeyWPLZBXLKMCIZHC-UHFFFAOYSA-N
MW373.41 g/mol
LogP3.88
Rot. Bonds5

About 4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one

4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one (PubChem CID 9327531) has the molecular formula C22H19N3O3 and a molecular weight of 373.41 g/mol. Its IUPAC name is 4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one.

Molecular Properties

Compound Name4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one
PubChem CID9327531
Molecular FormulaC22H19N3O3
Molecular Weight373.41 g/mol
Exact Mass373.14
IUPAC Name4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one
SMILESO=C1CN(C(=O)CNc2ccccc2Oc2ccccc2)c2ccccc2N1
InChIInChI=1S/C22H19N3O3/c26-21-15-25(19-12-6-4-10-17(19)24-21)22(27)14-23-18-11-5-7-13-20(18)28-16-8-2-1-3-9-16/h1-13,23H,14-15H2,(H,24,26)
InChIKeyWPLZBXLKMCIZHC-UHFFFAOYSA-N
XLogP3.88
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one 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

4-[2-(3-phenoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one
CID 2640660
N-[2-[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethoxy]phenyl]acetamide
CID 2411041
4-[2-[(2-methoxyphenyl)methylamino]acetyl]-1,3-dihydroquinoxalin-2-one
CID 2403769
4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one
CID 26860466
4-(2-nitrosoacetyl)-1,3-dihydroquinoxalin-2-one
CID 54465544
[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 2-hydroxy-2,2-diphenylacetate
CID 7191513
4-[2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetyl]-1,3-dihydroquinoxalin-2-one
CID 9133688
1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-(2-phenoxyanilino)ethanone
CID 2468474
2-hydroxy-N-[3-oxo-3-(3-oxo-2,4-dihydroquinoxalin-1-yl)propyl]acetamide
CID 163261629
4-(2-naphthalen-2-ylacetyl)-1,3-dihydroquinoxalin-2-one
CID 16864035
4-[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethoxy]benzonitrile
CID 7818538
4-[(2R)-2-phenoxybutanoyl]-1,3-dihydroquinoxalin-2-one
CID 40747048

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one?
The IUPAC name of 4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one (CID 9327531) is 4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one.
What is the SMILES notation for 4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one?
The canonical SMILES for 4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one is O=C1CN(C(=O)CNc2ccccc2Oc2ccccc2)c2ccccc2N1.
What is the InChIKey of 4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one?
The InChIKey is WPLZBXLKMCIZHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O3/c26-21-15-25(19-12-6-4-10-17(19)24-21)22(27)14-23-18-11-5-7-13-20(18)28-16-8-2-1-3-9-16/h1-13,23H,14-15H2,(H,24,26).
What are the key properties of 4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one?
4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one has a molecular weight of 373.41 g/mol, XLogP of 3.88, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-phenoxyanilino)acetyl]-1,3-dihydroquinoxalin-2-one is sourced from PubChem (CID 9327531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).