N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide

C18H20F2N2O3S — CID 26423277

IUPACN-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(CNC(=O)c2cc(F)ccc2F)cc1
InChIInChI=1S/C18H20F2N2O3S/c1-3-22(4-2)26(24,25)15-8-5-13(6-9-15)12-21-18(23)16-11-14(19)7-10-17(16)20/h5-11H,3-4,12H2,1-2H3,(H,21,23)
InChIKeyJHAPWKYIHMOCJP-UHFFFAOYSA-N
MW382.43 g/mol
LogP2.93
Rot. Bonds7

About N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide

N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide (PubChem CID 26423277) has the molecular formula C18H20F2N2O3S and a molecular weight of 382.43 g/mol. Its IUPAC name is N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide.

Molecular Properties

Compound NameN-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide
PubChem CID26423277
Molecular FormulaC18H20F2N2O3S
Molecular Weight382.43 g/mol
Exact Mass382.12
IUPAC NameN-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(CNC(=O)c2cc(F)ccc2F)cc1
InChIInChI=1S/C18H20F2N2O3S/c1-3-22(4-2)26(24,25)15-8-5-13(6-9-15)12-21-18(23)16-11-14(19)7-10-17(16)20/h5-11H,3-4,12H2,1-2H3,(H,21,23)
InChIKeyJHAPWKYIHMOCJP-UHFFFAOYSA-N
XLogP2.93
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.43
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide 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-(diethylsulfamoyl)phenyl]methyl]-3-fluorobenzamide
CID 7603385
N-[[4-(diethylaminomethyl)phenyl]methyl]-5-(dimethylsulfamoyl)-2-fluorobenzamide
CID 8948233
[2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 5-(diethylsulfamoyl)-2-fluorobenzoate
CID 16512419
N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-dimethylbenzamide
CID 9474464
N-[[4-(diethylsulfamoyl)phenyl]methyl]-2-(2,4-difluorophenyl)sulfanylacetamide
CID 26423929
N-[[4-(diethylsulfamoyl)phenyl]methyl]-3-(4-fluorophenyl)propanamide
CID 31747284
5-(diethylsulfamoyl)-2-fluoro-N-[[3-(propan-2-yloxymethyl)phenyl]methyl]benzamide
CID 55748210
N-[[4-(diethylsulfamoyl)phenyl]methyl]-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide
CID 55432850
N-(cyclopropylmethyl)-5-(diethylsulfamoyl)-2-fluorobenzamide
CID 34825943
N-[[4-(diethylsulfamoyl)phenyl]methyl]-3-(4-fluorophenyl)-2-sulfanylidene-1H-imidazole-4-carboxamide
CID 24549148
N-benzyl-2-chloro-5-(diethylsulfamoyl)benzamide
CID 1121797
N,N-diethyl-4-(ethylaminomethyl)benzenesulfonamide
CID 28715770

Frequently Asked Questions

What is the IUPAC name of N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide?
The IUPAC name of N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide (CID 26423277) is N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide.
What is the SMILES notation for N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide?
The canonical SMILES for N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide is CCN(CC)S(=O)(=O)c1ccc(CNC(=O)c2cc(F)ccc2F)cc1.
What is the InChIKey of N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide?
The InChIKey is JHAPWKYIHMOCJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20F2N2O3S/c1-3-22(4-2)26(24,25)15-8-5-13(6-9-15)12-21-18(23)16-11-14(19)7-10-17(16)20/h5-11H,3-4,12H2,1-2H3,(H,21,23).
What are the key properties of N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide?
N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide has a molecular weight of 382.43 g/mol, XLogP of 2.93, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(diethylsulfamoyl)phenyl]methyl]-2,5-difluorobenzamide is sourced from PubChem (CID 26423277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).