4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide

C16H19N3O3S — CID 53283335

IUPAC4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide
SMILESCN(C)S(=O)(=O)N(C)c1ccc(C(=O)Nc2ccccc2)cc1
InChIInChI=1S/C16H19N3O3S/c1-18(2)23(21,22)19(3)15-11-9-13(10-12-15)16(20)17-14-7-5-4-6-8-14/h4-12H,1-3H3,(H,17,20)
InChIKeySJLAEJCIIJSNOQ-UHFFFAOYSA-N
MW333.41 g/mol
LogP2.18
Rot. Bonds5

About 4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide

4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide (PubChem CID 53283335) has the molecular formula C16H19N3O3S and a molecular weight of 333.41 g/mol. Its IUPAC name is 4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide.

Molecular Properties

Compound Name4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide
PubChem CID53283335
Molecular FormulaC16H19N3O3S
Molecular Weight333.41 g/mol
Exact Mass333.11
IUPAC Name4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide
SMILESCN(C)S(=O)(=O)N(C)c1ccc(C(=O)Nc2ccccc2)cc1
InChIInChI=1S/C16H19N3O3S/c1-18(2)23(21,22)19(3)15-11-9-13(10-12-15)16(20)17-14-7-5-4-6-8-14/h4-12H,1-3H3,(H,17,20)
InChIKeySJLAEJCIIJSNOQ-UHFFFAOYSA-N
XLogP2.18
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.41
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-4-[dimethylsulfamoyl(methyl)amino]benzamide
CID 13322356
N-(3-acetylphenyl)-4-[dimethylsulfamoyl(methyl)amino]benzamide
CID 92664202
4-[dimethylsulfamoyl(methyl)amino]-N-(4-ethylphenyl)benzamide
CID 53283203
4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide
CID 53283134
4-[dimethylsulfamoyl(methyl)amino]-N-(2-fluorophenyl)benzamide
CID 53283277
4-[dimethylsulfamoyl(methyl)amino]-N-(4-pyrrolidin-1-ylphenyl)benzamide
CID 100504301
4-[dimethylsulfamoyl(methyl)amino]-N-[4-[(3-methylphenyl)sulfamoyl]phenyl]benzamide
CID 18891060
4-(dimethylsulfamoyl)-N-[4-(phenylcarbamoylamino)phenyl]benzamide
CID 18289472
4-[dimethylsulfamoyl(methyl)amino]-N-[2-(trifluoromethyl)phenyl]benzamide
CID 92664146
methyl 2-[[4-[dimethylsulfamoyl(methyl)amino]benzoyl]amino]benzoate
CID 92664116
N-[4-(azepan-1-ylsulfonyl)phenyl]-4-[dimethylsulfamoyl(methyl)amino]benzamide
CID 92642400
4-[methyl(methylsulfonyl)amino]-N-[3-[methyl(methylsulfonyl)amino]phenyl]benzamide
CID 1006597

Frequently Asked Questions

What is the IUPAC name of 4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide?
The IUPAC name of 4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide (CID 53283335) is 4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide.
What is the SMILES notation for 4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide?
The canonical SMILES for 4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide is CN(C)S(=O)(=O)N(C)c1ccc(C(=O)Nc2ccccc2)cc1.
What is the InChIKey of 4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide?
The InChIKey is SJLAEJCIIJSNOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3S/c1-18(2)23(21,22)19(3)15-11-9-13(10-12-15)16(20)17-14-7-5-4-6-8-14/h4-12H,1-3H3,(H,17,20).
What are the key properties of 4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide?
4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide has a molecular weight of 333.41 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide is sourced from PubChem (CID 53283335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).