3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide

C19H24N2O3S — CID 110425651

IUPAC3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide
SMILESCC(C)Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1
InChIInChI=1S/C19H24N2O3S/c1-14(2)11-15-7-5-9-17(12-15)20-19(22)16-8-6-10-18(13-16)25(23,24)21(3)4/h5-10,12-14H,11H2,1-4H3,(H,20,22)
InChIKeyHQUGVSCTRLLDMK-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.39
Rot. Bonds6

About 3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide

3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide (PubChem CID 110425651) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide
PubChem CID110425651
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC Name3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide
SMILESCC(C)Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1
InChIInChI=1S/C19H24N2O3S/c1-14(2)11-15-7-5-9-17(12-15)20-19(22)16-8-6-10-18(13-16)25(23,24)21(3)4/h5-10,12-14H,11H2,1-4H3,(H,20,22)
InChIKeyHQUGVSCTRLLDMK-UHFFFAOYSA-N
XLogP3.39
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide
CID 2221562
N-[3-[(4-tert-butylbenzoyl)amino]phenyl]-3-(dimethylsulfamoyl)benzamide
CID 100625475
N-(3-methylphenyl)-3-(2-methylpropyl)benzamide
CID 158758785
3-(dimethylsulfamoyl)-N-[3-[methyl(methylsulfonyl)amino]phenyl]benzamide
CID 100624777
N-[4-(dimethylamino)phenyl]-3-(dimethylsulfamoyl)benzamide
CID 110356126
3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide
CID 109064666
3-(dimethylsulfamoyl)-N-(2-methyl-3-phenylpropyl)benzamide
CID 110355133
3-[methyl(propan-2-yl)sulfamoyl]-N-[3-(pyrazol-1-ylmethyl)phenyl]benzamide
CID 46423962
N-[3-(dimethylsulfamoyl)phenyl]-3-nitrobenzamide
CID 9093681
N-[3-(dimethylsulfamoyl)phenyl]-4-methylsulfonylbenzamide
CID 9093665
3-(dimethylsulfamoyl)-N-[(2S)-3-methylbutan-2-yl]benzamide
CID 8923186
3-[[3-(bromomethyl)phenyl]carbamoyl]benzenesulfonyl fluoride
CID 125468112

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide (CID 110425651) is 3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide is CC(C)Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1.
What is the InChIKey of 3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide?
The InChIKey is HQUGVSCTRLLDMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-14(2)11-15-7-5-9-17(12-15)20-19(22)16-8-6-10-18(13-16)25(23,24)21(3)4/h5-10,12-14H,11H2,1-4H3,(H,20,22).
What are the key properties of 3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide?
3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide has a molecular weight of 360.48 g/mol, XLogP of 3.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide is sourced from PubChem (CID 110425651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).