2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide

C23H23N3O5S — CID 126029637

IUPAC2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide
SMILESCCOc1ccccc1N(CC(=O)Nc1ccccc1C(N)=O)S(=O)(=O)c1ccccc1
InChIInChI=1S/C23H23N3O5S/c1-2-31-21-15-9-8-14-20(21)26(32(29,30)17-10-4-3-5-11-17)16-22(27)25-19-13-7-6-12-18(19)23(24)28/h3-15H,2,16H2,1H3,(H2,24,28)(H,25,27)
InChIKeyGLXYQJFXNLOPEN-UHFFFAOYSA-N
MW453.52 g/mol
LogP3.02
Rot. Bonds9

About 2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide

2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide (PubChem CID 126029637) has the molecular formula C23H23N3O5S and a molecular weight of 453.52 g/mol. Its IUPAC name is 2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide.

Molecular Properties

Compound Name2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide
PubChem CID126029637
Molecular FormulaC23H23N3O5S
Molecular Weight453.52 g/mol
Exact Mass453.14
IUPAC Name2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide
SMILESCCOc1ccccc1N(CC(=O)Nc1ccccc1C(N)=O)S(=O)(=O)c1ccccc1
InChIInChI=1S/C23H23N3O5S/c1-2-31-21-15-9-8-14-20(21)26(32(29,30)17-10-4-3-5-11-17)16-22(27)25-19-13-7-6-12-18(19)23(24)28/h3-15H,2,16H2,1H3,(H2,24,28)(H,25,27)
InChIKeyGLXYQJFXNLOPEN-UHFFFAOYSA-N
XLogP3.02
TPSA118.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.52
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide 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-[N-(benzenesulfonyl)-2-ethoxyanilino]-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 126031095
2-[N-(benzenesulfonyl)-2-ethoxyanilino]-N-(2,4-difluorophenyl)acetamide
CID 1303646
N-benzyl-2-[[2-(2-ethoxy-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]benzamide
CID 126031358
2-[N-(benzenesulfonyl)anilino]-N-(2-ethoxyphenyl)acetamide
CID 1095152
2-[N-(benzenesulfonyl)-2-ethoxyanilino]-N-(4-methylphenyl)acetamide
CID 1364387
N-[(2S)-butan-2-yl]-2-[[2-(2-ethoxy-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]benzamide
CID 126121860
2-[N-(benzenesulfonyl)-2-ethoxyanilino]-N-(5-chloro-2-methylphenyl)acetamide
CID 1344293
2-[N-(benzenesulfonyl)-2-ethoxyanilino]-N-(3,5-dimethylphenyl)acetamide
CID 51345275
2-[[2-(N-(4-chlorophenyl)sulfonyl-2-ethoxyanilino)acetyl]amino]-N-(2-methylpropyl)benzamide
CID 126181164
2-[N-(benzenesulfonyl)-2-ethoxyanilino]-N-(4-phenoxyphenyl)acetamide
CID 51345277
2-(2-ethoxy-N-(4-methylphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide
CID 1210636
N-(2-ethoxyphenyl)-2-(2-methyl-N-(4-methylphenyl)sulfonylanilino)acetamide
CID 998705

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide?
The IUPAC name of 2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide (CID 126029637) is 2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide.
What is the SMILES notation for 2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide?
The canonical SMILES for 2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide is CCOc1ccccc1N(CC(=O)Nc1ccccc1C(N)=O)S(=O)(=O)c1ccccc1.
What is the InChIKey of 2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide?
The InChIKey is GLXYQJFXNLOPEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O5S/c1-2-31-21-15-9-8-14-20(21)26(32(29,30)17-10-4-3-5-11-17)16-22(27)25-19-13-7-6-12-18(19)23(24)28/h3-15H,2,16H2,1H3,(H2,24,28)(H,25,27).
What are the key properties of 2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide?
2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide has a molecular weight of 453.52 g/mol, XLogP of 3.02, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[N-(benzenesulfonyl)-2-ethoxyanilino]acetyl]amino]benzamide is sourced from PubChem (CID 126029637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).