1-fluoro-2-hydroxyethanesulfonamide

C2H6FNO3S — CID 167272265

IUPAC1-fluoro-2-hydroxyethanesulfonamide
SMILESNS(=O)(=O)C(F)CO
InChIInChI=1S/C2H6FNO3S/c3-2(1-5)8(4,6)7/h2,5H,1H2,(H2,4,6,7)
InChIKeyCWABEACNDPHLJD-UHFFFAOYSA-N
MW143.14 g/mol
LogP-1.44
Rot. Bonds2

About 1-fluoro-2-hydroxyethanesulfonamide

1-fluoro-2-hydroxyethanesulfonamide (PubChem CID 167272265) has the molecular formula C2H6FNO3S and a molecular weight of 143.14 g/mol. Its IUPAC name is 1-fluoro-2-hydroxyethanesulfonamide.

Molecular Properties

Compound Name1-fluoro-2-hydroxyethanesulfonamide
PubChem CID167272265
Molecular FormulaC2H6FNO3S
Molecular Weight143.14 g/mol
Exact Mass143.01
IUPAC Name1-fluoro-2-hydroxyethanesulfonamide
SMILESNS(=O)(=O)C(F)CO
InChIInChI=1S/C2H6FNO3S/c3-2(1-5)8(4,6)7/h2,5H,1H2,(H2,4,6,7)
InChIKeyCWABEACNDPHLJD-UHFFFAOYSA-N
XLogP-1.44
TPSA80.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.14
LogP ≤ 5-1.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-fluoro-2-hydroxyethanesulfonamide?
The IUPAC name of 1-fluoro-2-hydroxyethanesulfonamide (CID 167272265) is 1-fluoro-2-hydroxyethanesulfonamide.
What is the SMILES notation for 1-fluoro-2-hydroxyethanesulfonamide?
The canonical SMILES for 1-fluoro-2-hydroxyethanesulfonamide is NS(=O)(=O)C(F)CO.
What is the InChIKey of 1-fluoro-2-hydroxyethanesulfonamide?
The InChIKey is CWABEACNDPHLJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6FNO3S/c3-2(1-5)8(4,6)7/h2,5H,1H2,(H2,4,6,7).
What are the key properties of 1-fluoro-2-hydroxyethanesulfonamide?
1-fluoro-2-hydroxyethanesulfonamide has a molecular weight of 143.14 g/mol, XLogP of -1.44, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-2-hydroxyethanesulfonamide is sourced from PubChem (CID 167272265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).