pyridine-2-sulfonyl fluoride

C5H4FNO2S — CID 11615218

IUPACpyridine-2-sulfonyl fluoride
SMILESO=S(=O)(F)c1ccccn1
InChIInChI=1S/C5H4FNO2S/c6-10(8,9)5-3-1-2-4-7-5/h1-4H
InChIKeyFCFXLXGZHDHJLB-UHFFFAOYSA-N
MW161.16 g/mol
LogP0.74
Rot. Bonds1

About pyridine-2-sulfonyl fluoride

pyridine-2-sulfonyl fluoride (PubChem CID 11615218) has the molecular formula C5H4FNO2S and a molecular weight of 161.16 g/mol. Its IUPAC name is pyridine-2-sulfonyl fluoride.

Molecular Properties

Compound Namepyridine-2-sulfonyl fluoride
PubChem CID11615218
Molecular FormulaC5H4FNO2S
Molecular Weight161.16 g/mol
Exact Mass160.99
IUPAC Namepyridine-2-sulfonyl fluoride
SMILESO=S(=O)(F)c1ccccn1
InChIInChI=1S/C5H4FNO2S/c6-10(8,9)5-3-1-2-4-7-5/h1-4H
InChIKeyFCFXLXGZHDHJLB-UHFFFAOYSA-N
XLogP0.74
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.16
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of pyridine-2-sulfonyl fluoride?
The IUPAC name of pyridine-2-sulfonyl fluoride (CID 11615218) is pyridine-2-sulfonyl fluoride.
What is the SMILES notation for pyridine-2-sulfonyl fluoride?
The canonical SMILES for pyridine-2-sulfonyl fluoride is O=S(=O)(F)c1ccccn1.
What is the InChIKey of pyridine-2-sulfonyl fluoride?
The InChIKey is FCFXLXGZHDHJLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4FNO2S/c6-10(8,9)5-3-1-2-4-7-5/h1-4H.
What are the key properties of pyridine-2-sulfonyl fluoride?
pyridine-2-sulfonyl fluoride has a molecular weight of 161.16 g/mol, XLogP of 0.74, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyridine-2-sulfonyl fluoride is sourced from PubChem (CID 11615218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).