2-(2-fluorophenyl)-2-oxoethanesulfonamide

C8H8FNO3S — CID 115029878

IUPAC2-(2-fluorophenyl)-2-oxoethanesulfonamide
SMILESNS(=O)(=O)CC(=O)c1ccccc1F
InChIInChI=1S/C8H8FNO3S/c9-7-4-2-1-3-6(7)8(11)5-14(10,12)13/h1-4H,5H2,(H2,10,12,13)
InChIKeyFDAZPGZVPFGGPO-UHFFFAOYSA-N
MW217.22 g/mol
LogP0.30
Rot. Bonds3

About 2-(2-fluorophenyl)-2-oxoethanesulfonamide

2-(2-fluorophenyl)-2-oxoethanesulfonamide (PubChem CID 115029878) has the molecular formula C8H8FNO3S and a molecular weight of 217.22 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-2-oxoethanesulfonamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-2-oxoethanesulfonamide
PubChem CID115029878
Molecular FormulaC8H8FNO3S
Molecular Weight217.22 g/mol
Exact Mass217.02
IUPAC Name2-(2-fluorophenyl)-2-oxoethanesulfonamide
SMILESNS(=O)(=O)CC(=O)c1ccccc1F
InChIInChI=1S/C8H8FNO3S/c9-7-4-2-1-3-6(7)8(11)5-14(10,12)13/h1-4H,5H2,(H2,10,12,13)
InChIKeyFDAZPGZVPFGGPO-UHFFFAOYSA-N
XLogP0.30
TPSA77.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.22
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-2-oxoethanesulfonamide?
The IUPAC name of 2-(2-fluorophenyl)-2-oxoethanesulfonamide (CID 115029878) is 2-(2-fluorophenyl)-2-oxoethanesulfonamide.
What is the SMILES notation for 2-(2-fluorophenyl)-2-oxoethanesulfonamide?
The canonical SMILES for 2-(2-fluorophenyl)-2-oxoethanesulfonamide is NS(=O)(=O)CC(=O)c1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-2-oxoethanesulfonamide?
The InChIKey is FDAZPGZVPFGGPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FNO3S/c9-7-4-2-1-3-6(7)8(11)5-14(10,12)13/h1-4H,5H2,(H2,10,12,13).
What are the key properties of 2-(2-fluorophenyl)-2-oxoethanesulfonamide?
2-(2-fluorophenyl)-2-oxoethanesulfonamide has a molecular weight of 217.22 g/mol, XLogP of 0.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-2-oxoethanesulfonamide is sourced from PubChem (CID 115029878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).