N,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide

C16H18N2O3S — CID 3581351

IUPACN,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide
SMILESCNC(=O)c1ccc(C)c(S(=O)(=O)Nc2ccccc2C)c1
InChIInChI=1S/C16H18N2O3S/c1-11-6-4-5-7-14(11)18-22(20,21)15-10-13(16(19)17-3)9-8-12(15)2/h4-10,18H,1-3H3,(H,17,19)
InChIKeyBKNZBQVAOKCCCT-UHFFFAOYSA-N
MW318.40 g/mol
LogP2.46
Rot. Bonds4

About N,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide

N,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide (PubChem CID 3581351) has the molecular formula C16H18N2O3S and a molecular weight of 318.40 g/mol. Its IUPAC name is N,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide
PubChem CID3581351
Molecular FormulaC16H18N2O3S
Molecular Weight318.40 g/mol
Exact Mass318.10
IUPAC NameN,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide
SMILESCNC(=O)c1ccc(C)c(S(=O)(=O)Nc2ccccc2C)c1
InChIInChI=1S/C16H18N2O3S/c1-11-6-4-5-7-14(11)18-22(20,21)15-10-13(16(19)17-3)9-8-12(15)2/h4-10,18H,1-3H3,(H,17,19)
InChIKeyBKNZBQVAOKCCCT-UHFFFAOYSA-N
XLogP2.46
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.40
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,4-dimethyl-3-(phenylsulfamoyl)benzamide
CID 3894784
N-cyclopentyl-4-methyl-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 2223474
4-methyl-N-(3-methylphenyl)-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 3443148
N-(furan-2-ylmethyl)-4-methyl-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 1251601
4-methyl-N-[(1R)-1-(4-methylphenyl)propyl]-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 30400896
N-[(4-methoxyphenyl)methyl]-4-methyl-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 2234266
4-methyl-N-[1-(4-methylphenyl)propyl]-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 43906098
4-methyl-3-[(2-methylphenyl)sulfamoyl]-N-(pyridin-3-ylmethyl)benzamide
CID 3559507
4-methyl-3-[(2-methylphenyl)sulfamoyl]-N-[2-(2-methylpropylcarbamoyl)phenyl]benzamide
CID 126413403
2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide
CID 24502280
ethane;4-methyl-N-(2-methylphenyl)-3-[(3-methylphenyl)sulfamoyl]benzamide
CID 142804944
N-[4-[(2,3-dichlorophenyl)sulfamoyl]phenyl]-4-methyl-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 126412405

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide?
The IUPAC name of N,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide (CID 3581351) is N,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide?
The canonical SMILES for N,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide is CNC(=O)c1ccc(C)c(S(=O)(=O)Nc2ccccc2C)c1.
What is the InChIKey of N,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide?
The InChIKey is BKNZBQVAOKCCCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3S/c1-11-6-4-5-7-14(11)18-22(20,21)15-10-13(16(19)17-3)9-8-12(15)2/h4-10,18H,1-3H3,(H,17,19).
What are the key properties of N,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide?
N,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide has a molecular weight of 318.40 g/mol, XLogP of 2.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 3581351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).