N-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide

C16H16F2N2O3S — CID 110295940

IUPACN-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2ccc(F)cc2F)cc1S(=O)(=O)N(C)C
InChIInChI=1S/C16H16F2N2O3S/c1-10-4-5-11(8-15(10)24(22,23)20(2)3)16(21)19-14-7-6-12(17)9-13(14)18/h4-9H,1-3H3,(H,19,21)
InChIKeyUDERUKAZMRGSIC-UHFFFAOYSA-N
MW354.38 g/mol
LogP2.78
Rot. Bonds4

About N-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide

N-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide (PubChem CID 110295940) has the molecular formula C16H16F2N2O3S and a molecular weight of 354.38 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide
PubChem CID110295940
Molecular FormulaC16H16F2N2O3S
Molecular Weight354.38 g/mol
Exact Mass354.08
IUPAC NameN-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2ccc(F)cc2F)cc1S(=O)(=O)N(C)C
InChIInChI=1S/C16H16F2N2O3S/c1-10-4-5-11(8-15(10)24(22,23)20(2)3)16(21)19-14-7-6-12(17)9-13(14)18/h4-9H,1-3H3,(H,19,21)
InChIKeyUDERUKAZMRGSIC-UHFFFAOYSA-N
XLogP2.78
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.38
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-3-(dimethylsulfamoyl)-N-(2-fluoro-4-methylphenyl)benzamide
CID 26522880
N-(4-chloro-2-fluorophenyl)-3-(diethylsulfamoyl)-4-methylbenzamide
CID 26409898
3-amino-N-(2,4-difluorophenyl)-4-methylbenzamide
CID 16784210
1-N,4-N-bis(2,4-difluorophenyl)benzene-1,4-dicarboxamide
CID 3596826
3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)-4-methylbenzamide
CID 110295913
N-(2,4-dichlorophenyl)-3-(dimethylsulfamoyl)-4-fluorobenzamide
CID 55792661
3-(dimethylsulfamoyl)-4,5-dimethyl-N-(2,3,4-trifluorophenyl)benzamide
CID 30272949
N-(2,4-difluorophenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide
CID 9164980
methyl 4-[[3-(dimethylsulfamoyl)-4-methylbenzoyl]amino]benzoate
CID 110295930
3-(dimethylsulfamoyl)-N-[4-(4-fluorophenyl)butyl]-4-methylbenzamide
CID 110288744
4-chloro-N-(4-fluoro-2-methylphenyl)-3-methylsulfonylbenzamide
CID 26886366
3-(tert-butylsulfamoyl)-4-chloro-N-(2,4-difluorophenyl)benzamide
CID 34827235

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide?
The IUPAC name of N-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide (CID 110295940) is N-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide?
The canonical SMILES for N-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide is Cc1ccc(C(=O)Nc2ccc(F)cc2F)cc1S(=O)(=O)N(C)C.
What is the InChIKey of N-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide?
The InChIKey is UDERUKAZMRGSIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2N2O3S/c1-10-4-5-11(8-15(10)24(22,23)20(2)3)16(21)19-14-7-6-12(17)9-13(14)18/h4-9H,1-3H3,(H,19,21).
What are the key properties of N-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide?
N-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide has a molecular weight of 354.38 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-3-(dimethylsulfamoyl)-4-methylbenzamide is sourced from PubChem (CID 110295940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).