4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide

C24H25N3O5S — CID 30806172

IUPAC4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)Nc2cccc(NC(=O)COC)c2)cc1
InChIInChI=1S/C24H25N3O5S/c1-3-27(21-10-5-4-6-11-21)33(30,31)22-14-12-18(13-15-22)24(29)26-20-9-7-8-19(16-20)25-23(28)17-32-2/h4-16H,3,17H2,1-2H3,(H,25,28)(H,26,29)
InChIKeyTVMVUDXPSPDEFM-UHFFFAOYSA-N
MW467.55 g/mol
LogP3.74
Rot. Bonds9

About 4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide

4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide (PubChem CID 30806172) has the molecular formula C24H25N3O5S and a molecular weight of 467.55 g/mol. Its IUPAC name is 4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide.

Molecular Properties

Compound Name4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide
PubChem CID30806172
Molecular FormulaC24H25N3O5S
Molecular Weight467.55 g/mol
Exact Mass467.15
IUPAC Name4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)Nc2cccc(NC(=O)COC)c2)cc1
InChIInChI=1S/C24H25N3O5S/c1-3-27(21-10-5-4-6-11-21)33(30,31)22-14-12-18(13-15-22)24(29)26-20-9-7-8-19(16-20)25-23(28)17-32-2/h4-16H,3,17H2,1-2H3,(H,25,28)(H,26,29)
InChIKeyTVMVUDXPSPDEFM-UHFFFAOYSA-N
XLogP3.74
TPSA104.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.55
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[ethyl(phenyl)sulfamoyl]-N-pyridin-4-ylbenzamide
CID 24980451
N-(3-acetylphenyl)-3-[ethyl(phenyl)sulfamoyl]benzamide
CID 34830846
4-[ethyl(phenyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide
CID 2084993
4-[(2-methoxyacetyl)amino]-N-phenylbenzamide
CID 138999243
N-(4,5-dimethoxy-2-methylphenyl)-4-[ethyl(phenyl)sulfamoyl]benzamide
CID 17429226
4-[ethyl-(4-methylsulfanylphenyl)sulfonylamino]-N-(3-fluorophenyl)benzamide
CID 28591606
[2-(4-fluoroanilino)-2-oxoethyl] 4-[ethyl(phenyl)sulfamoyl]benzoate
CID 2588139
[2-(3-methylanilino)-2-oxoethyl] 3-[ethyl(phenyl)sulfamoyl]benzoate
CID 2579741
N-(1,3-benzothiazol-5-yl)-4-[ethyl(phenyl)sulfamoyl]benzamide
CID 18585536
N-ethoxy-4-[ethyl(phenyl)sulfamoyl]benzamide
CID 17481468
4-[ethyl(phenyl)sulfamoyl]-N-(5-methyl-1H-pyrazol-3-yl)benzamide
CID 60518994
N-(3-acetamidophenyl)-2-[4-[ethyl-(4-methylphenyl)sulfonylamino]phenoxy]acetamide
CID 17247359

Frequently Asked Questions

What is the IUPAC name of 4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide?
The IUPAC name of 4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide (CID 30806172) is 4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide.
What is the SMILES notation for 4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide?
The canonical SMILES for 4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide is CCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)Nc2cccc(NC(=O)COC)c2)cc1.
What is the InChIKey of 4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide?
The InChIKey is TVMVUDXPSPDEFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O5S/c1-3-27(21-10-5-4-6-11-21)33(30,31)22-14-12-18(13-15-22)24(29)26-20-9-7-8-19(16-20)25-23(28)17-32-2/h4-16H,3,17H2,1-2H3,(H,25,28)(H,26,29).
What are the key properties of 4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide?
4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide has a molecular weight of 467.55 g/mol, XLogP of 3.74, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[ethyl(phenyl)sulfamoyl]-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide is sourced from PubChem (CID 30806172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).