N-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide

C16H16F2N2O3S — CID 17457009

IUPACN-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide
SMILESCS(=O)(=O)NCCc1ccc(C(=O)Nc2cc(F)ccc2F)cc1
InChIInChI=1S/C16H16F2N2O3S/c1-24(22,23)19-9-8-11-2-4-12(5-3-11)16(21)20-15-10-13(17)6-7-14(15)18/h2-7,10,19H,8-9H2,1H3,(H,20,21)
InChIKeyLWXJOOOVJMIVIB-UHFFFAOYSA-N
MW354.38 g/mol
LogP2.31
Rot. Bonds6

About N-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide

N-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide (PubChem CID 17457009) has the molecular formula C16H16F2N2O3S and a molecular weight of 354.38 g/mol. Its IUPAC name is N-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide.

Molecular Properties

Compound NameN-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide
PubChem CID17457009
Molecular FormulaC16H16F2N2O3S
Molecular Weight354.38 g/mol
Exact Mass354.08
IUPAC NameN-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide
SMILESCS(=O)(=O)NCCc1ccc(C(=O)Nc2cc(F)ccc2F)cc1
InChIInChI=1S/C16H16F2N2O3S/c1-24(22,23)19-9-8-11-2-4-12(5-3-11)16(21)20-15-10-13(17)6-7-14(15)18/h2-7,10,19H,8-9H2,1H3,(H,20,21)
InChIKeyLWXJOOOVJMIVIB-UHFFFAOYSA-N
XLogP2.31
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.38
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]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-(2,4-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide
CID 27005483
N-(2-chloro-4-fluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide
CID 27005558
N-(4-fluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide
CID 18100481
4-(chloromethyl)-N-(2,5-difluorophenyl)benzamide
CID 43333434
N-(4-acetamidophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide
CID 22109501
4-chloro-N-(2,5-difluorophenyl)benzamide
CID 2969912
N-(2,4-difluorophenyl)-4-(methylsulfonylmethyl)benzamide
CID 9095339
N-(2,5-difluorophenyl)-4-(ethylamino)benzamide
CID 62172591
4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide
CID 27007439
4-(2-aminoethyl)-N-(2-chloro-5-fluorophenyl)benzamide
CID 107528464
N-(2,5-difluorophenyl)-4-phenylbenzamide
CID 7958887
N-(2,4-difluorophenyl)-4-ethylbenzamide
CID 2478391

Frequently Asked Questions

What is the IUPAC name of N-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide?
The IUPAC name of N-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide (CID 17457009) is N-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide.
What is the SMILES notation for N-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide?
The canonical SMILES for N-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide is CS(=O)(=O)NCCc1ccc(C(=O)Nc2cc(F)ccc2F)cc1.
What is the InChIKey of N-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide?
The InChIKey is LWXJOOOVJMIVIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2N2O3S/c1-24(22,23)19-9-8-11-2-4-12(5-3-11)16(21)20-15-10-13(17)6-7-14(15)18/h2-7,10,19H,8-9H2,1H3,(H,20,21).
What are the key properties of N-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide?
N-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide has a molecular weight of 354.38 g/mol, XLogP of 2.31, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-difluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide is sourced from PubChem (CID 17457009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).