3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide

C15H14F2N2O3S — CID 113094625

IUPAC3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide
SMILESCN(C(=O)c1ccc(F)c(F)c1)c1ccc(NS(C)(=O)=O)cc1
InChIInChI=1S/C15H14F2N2O3S/c1-19(15(20)10-3-8-13(16)14(17)9-10)12-6-4-11(5-7-12)18-23(2,21)22/h3-9,18H,1-2H3
InChIKeyYFJBVUPENITJDY-UHFFFAOYSA-N
MW340.35 g/mol
LogP2.61
Rot. Bonds4

About 3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide

3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide (PubChem CID 113094625) has the molecular formula C15H14F2N2O3S and a molecular weight of 340.35 g/mol. Its IUPAC name is 3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide.

Molecular Properties

Compound Name3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide
PubChem CID113094625
Molecular FormulaC15H14F2N2O3S
Molecular Weight340.35 g/mol
Exact Mass340.07
IUPAC Name3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide
SMILESCN(C(=O)c1ccc(F)c(F)c1)c1ccc(NS(C)(=O)=O)cc1
InChIInChI=1S/C15H14F2N2O3S/c1-19(15(20)10-3-8-13(16)14(17)9-10)12-6-4-11(5-7-12)18-23(2,21)22/h3-9,18H,1-2H3
InChIKeyYFJBVUPENITJDY-UHFFFAOYSA-N
XLogP2.61
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.35
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-[acetyl(methyl)amino]phenyl]-3,4-difluoro-N-methylbenzamide
CID 113094861
N-(4-aminophenyl)-3,4-difluoro-N-methylbenzamide
CID 28894090
N-(3,4-difluorophenyl)-4-(methanesulfonamido)benzamide
CID 1265569
4-(ethylsulfonylamino)-N-(4-fluorophenyl)-N-methylbenzamide
CID 100785367
3,4-difluoro-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107735801
N-[4-[2-(3,4-difluorophenyl)sulfanylpropanoyl]phenyl]methanesulfonamide
CID 18199605
N-[4-(benzenesulfonamido)phenyl]-4-chloro-N-methylbenzamide
CID 47784348
3-fluoro-N,4-dimethyl-N-(4-methylphenyl)benzamide
CID 52851115
4-chloro-N-cyclopropyl-N-[4-(methanesulfonamido)phenyl]benzamide
CID 113094726
[4-[methyl-(4-methylbenzoyl)amino]phenyl] 3,4-difluorobenzoate
CID 33186533
4-[(4-fluorophenyl)sulfonylamino]-N-methyl-N-phenylbenzamide
CID 51161114
N-[4-(methanesulfonamido)phenyl]-N-methylcyclohexanecarboxamide
CID 113094578

Frequently Asked Questions

What is the IUPAC name of 3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide?
The IUPAC name of 3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide (CID 113094625) is 3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide.
What is the SMILES notation for 3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide?
The canonical SMILES for 3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide is CN(C(=O)c1ccc(F)c(F)c1)c1ccc(NS(C)(=O)=O)cc1.
What is the InChIKey of 3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide?
The InChIKey is YFJBVUPENITJDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O3S/c1-19(15(20)10-3-8-13(16)14(17)9-10)12-6-4-11(5-7-12)18-23(2,21)22/h3-9,18H,1-2H3.
What are the key properties of 3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide?
3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide has a molecular weight of 340.35 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-difluoro-N-[4-(methanesulfonamido)phenyl]-N-methylbenzamide is sourced from PubChem (CID 113094625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).