N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide

C23H24N2O3S — CID 9098551

IUPACN-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide
SMILESCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1
InChIInChI=1S/C23H24N2O3S/c1-3-25(18-19-10-6-4-7-11-19)23(26)20-14-16-22(17-15-20)29(27,28)24(2)21-12-8-5-9-13-21/h4-17H,3,18H2,1-2H3
InChIKeyLIICLPBLQKGQGP-UHFFFAOYSA-N
MW408.52 g/mol
LogP4.17
Rot. Bonds7

About N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide

N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide (PubChem CID 9098551) has the molecular formula C23H24N2O3S and a molecular weight of 408.52 g/mol. Its IUPAC name is N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide
PubChem CID9098551
Molecular FormulaC23H24N2O3S
Molecular Weight408.52 g/mol
Exact Mass408.15
IUPAC NameN-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide
SMILESCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1
InChIInChI=1S/C23H24N2O3S/c1-3-25(18-19-10-6-4-7-11-19)23(26)20-14-16-22(17-15-20)29(27,28)24(2)21-12-8-5-9-13-21/h4-17H,3,18H2,1-2H3
InChIKeyLIICLPBLQKGQGP-UHFFFAOYSA-N
XLogP4.17
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.52
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dibenzyl-4-[(4-methoxyphenyl)sulfonyl-methylamino]benzamide
CID 126373552
4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide
CID 78784352
N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide
CID 21236527
N-butyl-N-(2-hydroxyethyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 78856047
1-N-benzyl-1-N,4-N-diethyl-4-N-phenylbenzene-1,4-dicarboxamide
CID 109047506
N-benzyl-4-[(4-methoxyphenyl)sulfonyl-methylamino]-N-methylbenzamide
CID 3472525
4-(dimethylsulfamoyl)-N-ethyl-N-(2-phenylethyl)benzamide
CID 55588043
N-benzyl-4-(diethylsulfamoyl)-N-propylbenzamide
CID 55344716
N,N-dibenzyl-4-[methyl(methylsulfonyl)amino]benzamide
CID 1312535
N-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide
CID 26731454
N-butyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide
CID 8839615
N-(1-aminopropan-2-yl)-N-methyl-4-[methyl(phenyl)sulfamoyl]benzamide
CID 119583533

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide?
The IUPAC name of N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide (CID 9098551) is N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide?
The canonical SMILES for N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide is CCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1.
What is the InChIKey of N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide?
The InChIKey is LIICLPBLQKGQGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3S/c1-3-25(18-19-10-6-4-7-11-19)23(26)20-14-16-22(17-15-20)29(27,28)24(2)21-12-8-5-9-13-21/h4-17H,3,18H2,1-2H3.
What are the key properties of N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide?
N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide has a molecular weight of 408.52 g/mol, XLogP of 4.17, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide is sourced from PubChem (CID 9098551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).