2-fluoropyridine-3-sulfonamide

C5H5FN2O2S — CID 129491008

IUPAC2-fluoropyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cccnc1F
InChIInChI=1S/C5H5FN2O2S/c6-5-4(11(7,9)10)2-1-3-8-5/h1-3H,(H2,7,9,10)
InChIKeyHIRZCYYTTIMHJK-UHFFFAOYSA-N
MW176.17 g/mol
LogP-0.13
Rot. Bonds1

About 2-fluoropyridine-3-sulfonamide

2-fluoropyridine-3-sulfonamide (PubChem CID 129491008) has the molecular formula C5H5FN2O2S and a molecular weight of 176.17 g/mol. Its IUPAC name is 2-fluoropyridine-3-sulfonamide.

Molecular Properties

Compound Name2-fluoropyridine-3-sulfonamide
PubChem CID129491008
Molecular FormulaC5H5FN2O2S
Molecular Weight176.17 g/mol
Exact Mass176.01
IUPAC Name2-fluoropyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cccnc1F
InChIInChI=1S/C5H5FN2O2S/c6-5-4(11(7,9)10)2-1-3-8-5/h1-3H,(H2,7,9,10)
InChIKeyHIRZCYYTTIMHJK-UHFFFAOYSA-N
XLogP-0.13
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.17
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-fluoropyridine-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-fluoropyridine-3-sulfonamide?
The IUPAC name of 2-fluoropyridine-3-sulfonamide (CID 129491008) is 2-fluoropyridine-3-sulfonamide.
What is the SMILES notation for 2-fluoropyridine-3-sulfonamide?
The canonical SMILES for 2-fluoropyridine-3-sulfonamide is NS(=O)(=O)c1cccnc1F.
What is the InChIKey of 2-fluoropyridine-3-sulfonamide?
The InChIKey is HIRZCYYTTIMHJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5FN2O2S/c6-5-4(11(7,9)10)2-1-3-8-5/h1-3H,(H2,7,9,10).
What are the key properties of 2-fluoropyridine-3-sulfonamide?
2-fluoropyridine-3-sulfonamide has a molecular weight of 176.17 g/mol, XLogP of -0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoropyridine-3-sulfonamide is sourced from PubChem (CID 129491008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).