N-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide

C19H24N2O3S — CID 51297168

IUPACN-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
SMILESCc1ccc(NC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1C
InChIInChI=1S/C19H24N2O3S/c1-13(2)21(5)25(23,24)18-10-7-16(8-11-18)19(22)20-17-9-6-14(3)15(4)12-17/h6-13H,1-5H3,(H,20,22)
InChIKeyAPBQPSIUPYAJHG-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.58
Rot. Bonds5

About N-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide

N-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide (PubChem CID 51297168) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
PubChem CID51297168
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC NameN-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
SMILESCc1ccc(NC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1C
InChIInChI=1S/C19H24N2O3S/c1-13(2)21(5)25(23,24)18-10-7-16(8-11-18)19(22)20-17-9-6-14(3)15(4)12-17/h6-13H,1-5H3,(H,20,22)
InChIKeyAPBQPSIUPYAJHG-UHFFFAOYSA-N
XLogP3.58
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,5-dichlorophenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 44993166
N-(1,3-dioxoisoindol-5-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 44993145
N-(5-fluoro-2-methylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 33314705
3,4-dichloro-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]benzamide
CID 8759609
N-(3-methoxyphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 41363704
N-[4-chloro-3-(trifluoromethyl)phenyl]-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 33314975
2-(3,4-dimethylphenyl)-N-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]acetamide
CID 8759555
N-(5-acetamido-2-fluorophenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 55551658
N-(2-methyl-4-propan-2-yloxyphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 55888323
4-(dimethylsulfamoyl)-N-(4-fluoro-3-methylphenyl)benzamide
CID 110776363
N-(4-bromo-3-methylphenyl)-4-(dimethylsulfamoyl)benzamide
CID 4264331
N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide
CID 9416096

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide?
The IUPAC name of N-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide (CID 51297168) is N-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide is Cc1ccc(NC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1C.
What is the InChIKey of N-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide?
The InChIKey is APBQPSIUPYAJHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-13(2)21(5)25(23,24)18-10-7-16(8-11-18)19(22)20-17-9-6-14(3)15(4)12-17/h6-13H,1-5H3,(H,20,22).
What are the key properties of N-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide?
N-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide has a molecular weight of 360.48 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide is sourced from PubChem (CID 51297168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).