N-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide

C15H14F2N2O3S — CID 2996034

IUPACN-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide
SMILESCCS(=O)(=O)Nc1ccc(C(=O)Nc2ccc(F)c(F)c2)cc1
InChIInChI=1S/C15H14F2N2O3S/c1-2-23(21,22)19-11-5-3-10(4-6-11)15(20)18-12-7-8-13(16)14(17)9-12/h3-9,19H,2H2,1H3,(H,18,20)
InChIKeyXJLWCTPIHZYWPH-UHFFFAOYSA-N
MW340.35 g/mol
LogP2.98
Rot. Bonds5

About N-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide

N-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide (PubChem CID 2996034) has the molecular formula C15H14F2N2O3S and a molecular weight of 340.35 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide
PubChem CID2996034
Molecular FormulaC15H14F2N2O3S
Molecular Weight340.35 g/mol
Exact Mass340.07
IUPAC NameN-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide
SMILESCCS(=O)(=O)Nc1ccc(C(=O)Nc2ccc(F)c(F)c2)cc1
InChIInChI=1S/C15H14F2N2O3S/c1-2-23(21,22)19-11-5-3-10(4-6-11)15(20)18-12-7-8-13(16)14(17)9-12/h3-9,19H,2H2,1H3,(H,18,20)
InChIKeyXJLWCTPIHZYWPH-UHFFFAOYSA-N
XLogP2.98
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.35
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide 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-(3,4-difluorophenyl)-4-(methanesulfonamido)benzamide
CID 1265569
N-(4-chlorophenyl)-4-(ethylsulfonylamino)benzamide
CID 92643113
4-(ethylsulfonylamino)-N-(3-methylphenyl)benzamide
CID 2996698
4-bromo-N-[4-(ethylsulfonylamino)phenyl]benzamide
CID 47051930
1-N-(3,4-difluorophenyl)-4-N,4-N-diethylbenzene-1,4-dicarboxamide
CID 109048473
1-N-(3,4-difluorophenyl)-4-N-propan-2-ylbenzene-1,4-dicarboxamide
CID 109043255
4-N-tert-butyl-1-N-(3,4-difluorophenyl)benzene-1,4-dicarboxamide
CID 48846340
N-(3,4-difluorophenyl)-4-(methylsulfanylmethyl)benzamide
CID 9165699
N-(3,4-difluorophenyl)-4-(prop-2-ynylsulfamoyl)benzamide
CID 33314597
N-(3,4-difluorophenyl)-3-[(1-ethylcyclopropyl)sulfonylamino]-4-fluorobenzamide
CID 90259156
N-[4-(2-amino-2-oxoethyl)phenyl]-4-(ethylsulfonylamino)benzamide
CID 100785351
N-(3,4-difluorophenyl)-3,4-diethoxybenzamide
CID 3371741

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide?
The IUPAC name of N-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide (CID 2996034) is N-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide?
The canonical SMILES for N-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide is CCS(=O)(=O)Nc1ccc(C(=O)Nc2ccc(F)c(F)c2)cc1.
What is the InChIKey of N-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide?
The InChIKey is XJLWCTPIHZYWPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O3S/c1-2-23(21,22)19-11-5-3-10(4-6-11)15(20)18-12-7-8-13(16)14(17)9-12/h3-9,19H,2H2,1H3,(H,18,20).
What are the key properties of N-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide?
N-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide has a molecular weight of 340.35 g/mol, XLogP of 2.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-4-(ethylsulfonylamino)benzamide is sourced from PubChem (CID 2996034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).