4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide

C19H25N3O3S — CID 53283134

IUPAC4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide
SMILESCC(C)c1ccc(NC(=O)c2ccc(N(C)S(=O)(=O)N(C)C)cc2)cc1
InChIInChI=1S/C19H25N3O3S/c1-14(2)15-6-10-17(11-7-15)20-19(23)16-8-12-18(13-9-16)22(5)26(24,25)21(3)4/h6-14H,1-5H3,(H,20,23)
InChIKeyJZYMAJQGVKBMKK-UHFFFAOYSA-N
MW375.49 g/mol
LogP3.30
Rot. Bonds6

About 4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide

4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide (PubChem CID 53283134) has the molecular formula C19H25N3O3S and a molecular weight of 375.49 g/mol. Its IUPAC name is 4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide.

Molecular Properties

Compound Name4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide
PubChem CID53283134
Molecular FormulaC19H25N3O3S
Molecular Weight375.49 g/mol
Exact Mass375.16
IUPAC Name4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide
SMILESCC(C)c1ccc(NC(=O)c2ccc(N(C)S(=O)(=O)N(C)C)cc2)cc1
InChIInChI=1S/C19H25N3O3S/c1-14(2)15-6-10-17(11-7-15)20-19(23)16-8-12-18(13-9-16)22(5)26(24,25)21(3)4/h6-14H,1-5H3,(H,20,23)
InChIKeyJZYMAJQGVKBMKK-UHFFFAOYSA-N
XLogP3.30
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.49
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-4-[dimethylsulfamoyl(methyl)amino]benzamide
CID 13322356
4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide
CID 53283335
4-propan-2-yl-N-(4-propan-2-ylphenyl)benzamide
CID 1406437
4-[dimethylsulfamoyl(methyl)amino]-N-(4-ethylphenyl)benzamide
CID 53283203
4-[(4-methoxyphenyl)sulfonyl-methylamino]-N-(4-propan-2-ylphenyl)benzamide
CID 1289268
4-[dimethylsulfamoyl(methyl)amino]-N-(4-pyrrolidin-1-ylphenyl)benzamide
CID 100504301
N-(3-chloro-4-methoxyphenyl)-4-[dimethylsulfamoyl(methyl)amino]benzamide
CID 92664148
N-(3-acetylphenyl)-4-[dimethylsulfamoyl(methyl)amino]benzamide
CID 92664202
N-[4-(azepan-1-ylsulfonyl)phenyl]-4-[dimethylsulfamoyl(methyl)amino]benzamide
CID 92642400
1-N,3-N,5-N-tris(4-propan-2-ylphenyl)benzene-1,3,5-tricarboxamide
CID 67992142
4-[dimethylsulfamoyl(methyl)amino]-N-[(1S)-1-(4-ethylphenyl)ethyl]benzamide
CID 100518140
4-[dimethylsulfamoyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]benzamide
CID 133161416

Frequently Asked Questions

What is the IUPAC name of 4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide?
The IUPAC name of 4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide (CID 53283134) is 4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide.
What is the SMILES notation for 4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide?
The canonical SMILES for 4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide is CC(C)c1ccc(NC(=O)c2ccc(N(C)S(=O)(=O)N(C)C)cc2)cc1.
What is the InChIKey of 4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide?
The InChIKey is JZYMAJQGVKBMKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3S/c1-14(2)15-6-10-17(11-7-15)20-19(23)16-8-12-18(13-9-16)22(5)26(24,25)21(3)4/h6-14H,1-5H3,(H,20,23).
What are the key properties of 4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide?
4-[dimethylsulfamoyl(methyl)amino]-N-(4-propan-2-ylphenyl)benzamide has a molecular weight of 375.49 g/mol, XLogP of 3.30, 6 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-(4-propan-2-ylphenyl)benzamide is sourced from PubChem (CID 53283134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).