2-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide

C8H11FN2O3S — CID 101227610

IUPAC2-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide
SMILESCC(F)C(O)c1ncccc1S(N)(=O)=O
InChIInChI=1S/C8H11FN2O3S/c1-5(9)8(12)7-6(15(10,13)14)3-2-4-11-7/h2-5,8,12H,1H3,(H2,10,13,14)
InChIKeyNNQAUWBZZUGOOO-UHFFFAOYSA-N
MW234.25 g/mol
LogP0.12
Rot. Bonds3

About 2-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide

2-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide (PubChem CID 101227610) has the molecular formula C8H11FN2O3S and a molecular weight of 234.25 g/mol. Its IUPAC name is 2-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide
PubChem CID101227610
Molecular FormulaC8H11FN2O3S
Molecular Weight234.25 g/mol
Exact Mass234.05
IUPAC Name2-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide
SMILESCC(F)C(O)c1ncccc1S(N)(=O)=O
InChIInChI=1S/C8H11FN2O3S/c1-5(9)8(12)7-6(15(10,13)14)3-2-4-11-7/h2-5,8,12H,1H3,(H2,10,13,14)
InChIKeyNNQAUWBZZUGOOO-UHFFFAOYSA-N
XLogP0.12
TPSA93.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2-fluoro-1-hydroxypropyl)pyridine-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-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide?
The IUPAC name of 2-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide (CID 101227610) is 2-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide?
The canonical SMILES for 2-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide is CC(F)C(O)c1ncccc1S(N)(=O)=O.
What is the InChIKey of 2-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide?
The InChIKey is NNQAUWBZZUGOOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2O3S/c1-5(9)8(12)7-6(15(10,13)14)3-2-4-11-7/h2-5,8,12H,1H3,(H2,10,13,14).
What are the key properties of 2-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide?
2-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide has a molecular weight of 234.25 g/mol, XLogP of 0.12, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-1-hydroxypropyl)pyridine-3-sulfonamide is sourced from PubChem (CID 101227610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).