3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide

C16H18N2O3S — CID 2221549

IUPAC3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide
SMILESCc1ccccc1NC(=O)c1cccc(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C16H18N2O3S/c1-12-7-4-5-10-15(12)17-16(19)13-8-6-9-14(11-13)22(20,21)18(2)3/h4-11H,1-3H3,(H,17,19)
InChIKeyDJWIYKNELLTEAL-UHFFFAOYSA-N
MW318.40 g/mol
LogP2.50
Rot. Bonds4

About 3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide

3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide (PubChem CID 2221549) has the molecular formula C16H18N2O3S and a molecular weight of 318.40 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide
PubChem CID2221549
Molecular FormulaC16H18N2O3S
Molecular Weight318.40 g/mol
Exact Mass318.10
IUPAC Name3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide
SMILESCc1ccccc1NC(=O)c1cccc(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C16H18N2O3S/c1-12-7-4-5-10-15(12)17-16(19)13-8-6-9-14(11-13)22(20,21)18(2)3/h4-11H,1-3H3,(H,17,19)
InChIKeyDJWIYKNELLTEAL-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

N-[2-(2-amino-2-oxoethyl)phenyl]-3-(dimethylsulfamoyl)benzamide
CID 55603942
N,N-dimethyl-3-[2-(2-methylanilino)acetyl]benzenesulfonamide
CID 110824385
3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
CID 2591093
3-(dimethylsulfamoyl)-N-(2-piperidin-1-ylphenyl)benzamide
CID 2426815
N-(5-chloro-2-fluorophenyl)-3-(dimethylsulfamoyl)benzamide
CID 2664609
3-(dimethylsulfamoyl)-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]benzamide
CID 55341476
N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide
CID 100624742
3-[(3,5-dimethylphenyl)sulfamoyl]-N-(2-methylphenyl)benzamide
CID 109065704
N-(2-methylphenyl)-3-(2-methylpropylsulfamoyl)benzamide
CID 109062702
3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide
CID 2379537
N-butan-2-yl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide
CID 133231331
4-(dimethylsulfamoyl)-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6503064

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide (CID 2221549) is 3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide is Cc1ccccc1NC(=O)c1cccc(S(=O)(=O)N(C)C)c1.
What is the InChIKey of 3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide?
The InChIKey is DJWIYKNELLTEAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3S/c1-12-7-4-5-10-15(12)17-16(19)13-8-6-9-14(11-13)22(20,21)18(2)3/h4-11H,1-3H3,(H,17,19).
What are the key properties of 3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide?
3-(dimethylsulfamoyl)-N-(2-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 3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide is sourced from PubChem (CID 2221549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).