N-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide

C17H19N3O4S — CID 4788124

IUPACN-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide
SMILESCN(C)S(=O)(=O)c1ccc(NC(=O)CNC(=O)c2ccccc2)cc1
InChIInChI=1S/C17H19N3O4S/c1-20(2)25(23,24)15-10-8-14(9-11-15)19-16(21)12-18-17(22)13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H,18,22)(H,19,21)
InChIKeyUQLISXAFKKNVMC-UHFFFAOYSA-N
MW361.42 g/mol
LogP1.31
Rot. Bonds6

About N-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide

N-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide (PubChem CID 4788124) has the molecular formula C17H19N3O4S and a molecular weight of 361.42 g/mol. Its IUPAC name is N-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide
PubChem CID4788124
Molecular FormulaC17H19N3O4S
Molecular Weight361.42 g/mol
Exact Mass361.11
IUPAC NameN-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide
SMILESCN(C)S(=O)(=O)c1ccc(NC(=O)CNC(=O)c2ccccc2)cc1
InChIInChI=1S/C17H19N3O4S/c1-20(2)25(23,24)15-10-8-14(9-11-15)19-16(21)12-18-17(22)13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H,18,22)(H,19,21)
InChIKeyUQLISXAFKKNVMC-UHFFFAOYSA-N
XLogP1.31
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.42
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(dimethylsulfamoyl)-N-[2-(4-ethylanilino)-2-oxoethyl]benzamide
CID 8623572
4-(dimethylsulfamoyl)-N-[4-(phenylcarbamoylamino)phenyl]benzamide
CID 18289472
N-[2-[4-(cyanomethyl)anilino]-2-oxoethyl]-3-(dimethylsulfamoyl)benzamide
CID 9261099
4-(benzamidocarbamoyl)-N,N-dimethylbenzenesulfonamide
CID 3304166
N-[2-(2,4-dimethylanilino)-2-oxoethyl]-4-(dimethylsulfamoyl)benzamide
CID 112996377
3-(dimethylsulfamoyl)-N-[2-[(9-ethylcarbazol-3-yl)amino]-2-oxoethyl]benzamide
CID 35508229
N-[4-(dimethylsulfamoyl)phenyl]-2-phenylsulfanylacetamide
CID 2082856
2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 18170938
N-(2-anilino-2-oxoethyl)-4-methylbenzamide
CID 4010991
N-[(4-acetamidophenyl)methyl]-4-(dimethylsulfamoyl)benzamide
CID 8006630
4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 24638138
N-(2-anilino-2-oxoethyl)-4-(prop-2-ynylsulfamoyl)benzamide
CID 55837048

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide?
The IUPAC name of N-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide (CID 4788124) is N-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide is CN(C)S(=O)(=O)c1ccc(NC(=O)CNC(=O)c2ccccc2)cc1.
What is the InChIKey of N-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide?
The InChIKey is UQLISXAFKKNVMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O4S/c1-20(2)25(23,24)15-10-8-14(9-11-15)19-16(21)12-18-17(22)13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H,18,22)(H,19,21).
What are the key properties of N-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide?
N-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide has a molecular weight of 361.42 g/mol, XLogP of 1.31, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide is sourced from PubChem (CID 4788124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).