4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide

C18H22N2O3S — CID 113091738

IUPAC4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)NC(C)(C)c2ccccc2)cc1
InChIInChI=1S/C18H22N2O3S/c1-18(2,15-8-6-5-7-9-15)19-17(21)14-10-12-16(13-11-14)24(22,23)20(3)4/h5-13H,1-4H3,(H,19,21)
InChIKeyNXCJARNQZSRDAS-UHFFFAOYSA-N
MW346.45 g/mol
LogP2.60
Rot. Bonds5

About 4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide

4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide (PubChem CID 113091738) has the molecular formula C18H22N2O3S and a molecular weight of 346.45 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide
PubChem CID113091738
Molecular FormulaC18H22N2O3S
Molecular Weight346.45 g/mol
Exact Mass346.14
IUPAC Name4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)NC(C)(C)c2ccccc2)cc1
InChIInChI=1S/C18H22N2O3S/c1-18(2,15-8-6-5-7-9-15)19-17(21)14-10-12-16(13-11-14)24(22,23)20(3)4/h5-13H,1-4H3,(H,19,21)
InChIKeyNXCJARNQZSRDAS-UHFFFAOYSA-N
XLogP2.60
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.45
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(benzamidocarbamoyl)-N,N-dimethylbenzenesulfonamide
CID 3304166
N-(2-phenylpropan-2-yl)-4-(trifluoromethyl)benzamide
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4-bromo-N-(2-phenylpropan-2-yl)benzamide
CID 47444769
4-(dimethylsulfamoyl)-N-(2,4,4-trimethylpentan-2-yl)benzamide
CID 51188883
N,N-dimethyl-4-[(N-phenylanilino)carbamoyl]benzenesulfonamide
CID 7760850
4-(dimethylsulfamoyl)-N-[4-(phenylcarbamoylamino)phenyl]benzamide
CID 18289472
4-(dimethylsulfamoyl)-N-(1-phenylethyl)benzamide
CID 2914743
4-[benzyl(methyl)sulfamoyl]-N-tert-butylbenzamide
CID 109060739
4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 24638138
N-[(2R)-2-cyclopropyl-2-hydroxy-2-phenylethyl]-4-(dimethylsulfamoyl)benzamide
CID 95379451
N-[(1R)-2-(dimethylamino)-1-phenylethyl]-4-(dimethylsulfamoyl)benzamide
CID 8936839
3-[4-(dimethylsulfamoyl)phenyl]-N-(1,1-diphenylethyl)prop-2-enamide
CID 72686736

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide (CID 113091738) is 4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide is CN(C)S(=O)(=O)c1ccc(C(=O)NC(C)(C)c2ccccc2)cc1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide?
The InChIKey is NXCJARNQZSRDAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3S/c1-18(2,15-8-6-5-7-9-15)19-17(21)14-10-12-16(13-11-14)24(22,23)20(3)4/h5-13H,1-4H3,(H,19,21).
What are the key properties of 4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide?
4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide has a molecular weight of 346.45 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-(2-phenylpropan-2-yl)benzamide is sourced from PubChem (CID 113091738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).