N-(2,6-difluorophenyl)ethanesulfonamide

C8H9F2NO2S — CID 60642898

IUPACN-(2,6-difluorophenyl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1c(F)cccc1F
InChIInChI=1S/C8H9F2NO2S/c1-2-14(12,13)11-8-6(9)4-3-5-7(8)10/h3-5,11H,2H2,1H3
InChIKeyIENYMRXHNCUSCW-UHFFFAOYSA-N
MW221.23 g/mol
LogP1.73
Rot. Bonds3

About N-(2,6-difluorophenyl)ethanesulfonamide

N-(2,6-difluorophenyl)ethanesulfonamide (PubChem CID 60642898) has the molecular formula C8H9F2NO2S and a molecular weight of 221.23 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)ethanesulfonamide
PubChem CID60642898
Molecular FormulaC8H9F2NO2S
Molecular Weight221.23 g/mol
Exact Mass221.03
IUPAC NameN-(2,6-difluorophenyl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1c(F)cccc1F
InChIInChI=1S/C8H9F2NO2S/c1-2-14(12,13)11-8-6(9)4-3-5-7(8)10/h3-5,11H,2H2,1H3
InChIKeyIENYMRXHNCUSCW-UHFFFAOYSA-N
XLogP1.73
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.23
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-difluorophenyl)propane-1-sulfonamide
CID 60640758
N-(2,3-difluorophenyl)ethanesulfonamide
CID 64586893
N-(2,3,4,5,6-pentafluorophenyl)ethanesulfonamide
CID 3375683
methyl 4-[(2,6-difluorophenyl)sulfamoyl]butanoate
CID 61460236
N-(2,6-difluorophenyl)-4-propylbenzenesulfonamide
CID 8500875
2-(cyclopropylamino)-N-(2,6-difluorophenyl)ethanesulfonamide
CID 114134282
4-[(2S)-butan-2-yl]-N-(2,6-difluorophenyl)benzenesulfonamide
CID 8500871
N-(2,6-difluorophenyl)-1,1,1-trifluoromethanesulfonamide
CID 5314606
N-(ethylsulfonimidoyl)-2-fluoro-6-methylaniline
CID 164657353
4-(ethylamino)-N-(2-fluoro-6-methylphenyl)butane-1-sulfonamide
CID 106083705
N-(2,6-difluorophenyl)-3,4-difluorobenzenesulfonamide
CID 8500850
N-(2-bromo-6-fluorophenyl)-3-(methylamino)propane-1-sulfonamide
CID 106089645

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)ethanesulfonamide?
The IUPAC name of N-(2,6-difluorophenyl)ethanesulfonamide (CID 60642898) is N-(2,6-difluorophenyl)ethanesulfonamide.
What is the SMILES notation for N-(2,6-difluorophenyl)ethanesulfonamide?
The canonical SMILES for N-(2,6-difluorophenyl)ethanesulfonamide is CCS(=O)(=O)Nc1c(F)cccc1F.
What is the InChIKey of N-(2,6-difluorophenyl)ethanesulfonamide?
The InChIKey is IENYMRXHNCUSCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F2NO2S/c1-2-14(12,13)11-8-6(9)4-3-5-7(8)10/h3-5,11H,2H2,1H3.
What are the key properties of N-(2,6-difluorophenyl)ethanesulfonamide?
N-(2,6-difluorophenyl)ethanesulfonamide has a molecular weight of 221.23 g/mol, XLogP of 1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)ethanesulfonamide is sourced from PubChem (CID 60642898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).