N-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide

C16H18N2O3S — CID 17397410

IUPACN-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide
SMILESCc1ccc(NC(=O)c2ccccc2)cc1S(=O)(=O)N(C)C
InChIInChI=1S/C16H18N2O3S/c1-12-9-10-14(11-15(12)22(20,21)18(2)3)17-16(19)13-7-5-4-6-8-13/h4-11H,1-3H3,(H,17,19)
InChIKeyOALFFGNRWWTPTH-UHFFFAOYSA-N
MW318.40 g/mol
LogP2.50
Rot. Bonds4

About N-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide

N-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide (PubChem CID 17397410) has the molecular formula C16H18N2O3S and a molecular weight of 318.40 g/mol. Its IUPAC name is N-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide.

Molecular Properties

Compound NameN-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide
PubChem CID17397410
Molecular FormulaC16H18N2O3S
Molecular Weight318.40 g/mol
Exact Mass318.10
IUPAC NameN-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide
SMILESCc1ccc(NC(=O)c2ccccc2)cc1S(=O)(=O)N(C)C
InChIInChI=1S/C16H18N2O3S/c1-12-9-10-14(11-15(12)22(20,21)18(2)3)17-16(19)13-7-5-4-6-8-13/h4-11H,1-3H3,(H,17,19)
InChIKeyOALFFGNRWWTPTH-UHFFFAOYSA-N
XLogP2.50
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.40
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyano-N-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide
CID 8893485
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-4-ethoxybenzamide
CID 3635933
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-4-(trifluoromethoxy)benzamide
CID 4280881
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-4-methyl-3-nitrobenzamide
CID 25435478
4-chloro-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-sulfamoylbenzamide
CID 24635521
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-phenyl-1,3-thiazole-5-carboxamide
CID 78877447
methyl 4-[[3-(dimethylsulfamoyl)-4-methylbenzoyl]amino]benzoate
CID 110295930
4-[[3-(diethylsulfamoyl)-4-methylphenyl]carbamoyl]benzoic acid
CID 45337189
(2S)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-phenoxypropanamide
CID 7812070
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-phenoxypropanamide
CID 5138475
N-[3-[[3-(dimethylsulfamoyl)phenyl]methylamino]-4-methylphenyl]benzamide
CID 55898387
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2,2,2-trifluoroacetamide
CID 62735221

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide?
The IUPAC name of N-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide (CID 17397410) is N-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide.
What is the SMILES notation for N-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide?
The canonical SMILES for N-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide is Cc1ccc(NC(=O)c2ccccc2)cc1S(=O)(=O)N(C)C.
What is the InChIKey of N-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide?
The InChIKey is OALFFGNRWWTPTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3S/c1-12-9-10-14(11-15(12)22(20,21)18(2)3)17-16(19)13-7-5-4-6-8-13/h4-11H,1-3H3,(H,17,19).
What are the key properties of N-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide?
N-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide has a molecular weight of 318.40 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylsulfamoyl)-4-methylphenyl]benzamide is sourced from PubChem (CID 17397410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).