4-[dimethylsulfamoyl(methyl)amino]-N-(4-phenylbutan-2-yl)benzamide

C20H27N3O3S — CID 132763060

IUPAC4-[dimethylsulfamoyl(methyl)amino]-N-(4-phenylbutan-2-yl)benzamide
SMILESCC(CCc1ccccc1)NC(=O)c1ccc(N(C)S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C20H27N3O3S/c1-16(10-11-17-8-6-5-7-9-17)21-20(24)18-12-14-19(15-13-18)23(4)27(25,26)22(2)3/h5-9,12-16H,10-11H2,1-4H3,(H,21,24)
InChIKeyQZKAROZFEUUREJ-UHFFFAOYSA-N
MW389.52 g/mol
LogP2.68
Rot. Bonds8

About 4-[dimethylsulfamoyl(methyl)amino]-N-(4-phenylbutan-2-yl)benzamide

4-[dimethylsulfamoyl(methyl)amino]-N-(4-phenylbutan-2-yl)benzamide (PubChem CID 132763060) has the molecular formula C20H27N3O3S and a molecular weight of 389.52 g/mol. Its IUPAC name is 4-[dimethylsulfamoyl(methyl)amino]-N-(4-phenylbutan-2-yl)benzamide.

Molecular Properties

Compound Name4-[dimethylsulfamoyl(methyl)amino]-N-(4-phenylbutan-2-yl)benzamide
PubChem CID132763060
Molecular FormulaC20H27N3O3S
Molecular Weight389.52 g/mol
Exact Mass389.18
IUPAC Name4-[dimethylsulfamoyl(methyl)amino]-N-(4-phenylbutan-2-yl)benzamide
SMILESCC(CCc1ccccc1)NC(=O)c1ccc(N(C)S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C20H27N3O3S/c1-16(10-11-17-8-6-5-7-9-17)21-20(24)18-12-14-19(15-13-18)23(4)27(25,26)22(2)3/h5-9,12-16H,10-11H2,1-4H3,(H,21,24)
InChIKeyQZKAROZFEUUREJ-UHFFFAOYSA-N
XLogP2.68
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.52
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[methyl-(4-methylphenyl)sulfonylamino]-N-(4-phenylbutan-2-yl)benzamide
CID 24538311
4-[dimethylsulfamoyl(methyl)amino]-N-pentan-3-ylbenzamide
CID 53283300
N-(4-phenylbutan-2-yl)-4-sulfanylbenzamide
CID 107026940
3-[methyl-(4-methylphenyl)sulfamoyl]-N-(4-phenylbutan-2-yl)benzamide
CID 132670833
4-[dimethylsulfamoyl(methyl)amino]-N-phenylbenzamide
CID 53283335
4-[(4-fluorophenyl)methyl-methylsulfonylamino]-N-(4-phenylbutan-2-yl)benzamide
CID 19062213
4-[benzenesulfonyl(methyl)amino]-N-[(2R)-pentan-2-yl]benzamide
CID 1296697
4-methoxy-N-[(2R)-4-phenylbutan-2-yl]benzamide
CID 854833
N-(4-phenylbutan-2-yl)pyridine-4-carboxamide
CID 3246771
4-[dimethylsulfamoyl(methyl)amino]-N-[1-(4-ethylphenyl)ethyl]benzamide
CID 133161416
4-[dimethylsulfamoyl(methyl)amino]-N-[(1S)-1-(4-ethylphenyl)ethyl]benzamide
CID 100518140
N-[(2S)-4-phenylbutan-2-yl]-4-propan-2-yloxybenzamide
CID 1263174

Frequently Asked Questions

What is the IUPAC name of 4-[dimethylsulfamoyl(methyl)amino]-N-(4-phenylbutan-2-yl)benzamide?
The IUPAC name of 4-[dimethylsulfamoyl(methyl)amino]-N-(4-phenylbutan-2-yl)benzamide (CID 132763060) is 4-[dimethylsulfamoyl(methyl)amino]-N-(4-phenylbutan-2-yl)benzamide.
What is the SMILES notation for 4-[dimethylsulfamoyl(methyl)amino]-N-(4-phenylbutan-2-yl)benzamide?
The canonical SMILES for 4-[dimethylsulfamoyl(methyl)amino]-N-(4-phenylbutan-2-yl)benzamide is CC(CCc1ccccc1)NC(=O)c1ccc(N(C)S(=O)(=O)N(C)C)cc1.
What is the InChIKey of 4-[dimethylsulfamoyl(methyl)amino]-N-(4-phenylbutan-2-yl)benzamide?
The InChIKey is QZKAROZFEUUREJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O3S/c1-16(10-11-17-8-6-5-7-9-17)21-20(24)18-12-14-19(15-13-18)23(4)27(25,26)22(2)3/h5-9,12-16H,10-11H2,1-4H3,(H,21,24).
What are the key properties of 4-[dimethylsulfamoyl(methyl)amino]-N-(4-phenylbutan-2-yl)benzamide?
4-[dimethylsulfamoyl(methyl)amino]-N-(4-phenylbutan-2-yl)benzamide has a molecular weight of 389.52 g/mol, XLogP of 2.68, 8 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-phenylbutan-2-yl)benzamide is sourced from PubChem (CID 132763060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).