2-(2-fluoroethylsulfonyl)pyrazine

C6H7FN2O2S — CID 130684185

IUPAC2-(2-fluoroethylsulfonyl)pyrazine
SMILESO=S(=O)(CCF)c1cnccn1
InChIInChI=1S/C6H7FN2O2S/c7-1-4-12(10,11)6-5-8-2-3-9-6/h2-3,5H,1,4H2
InChIKeyJVRPXUPZXSISAO-UHFFFAOYSA-N
MW190.20 g/mol
LogP0.22
Rot. Bonds3

About 2-(2-fluoroethylsulfonyl)pyrazine

2-(2-fluoroethylsulfonyl)pyrazine (PubChem CID 130684185) has the molecular formula C6H7FN2O2S and a molecular weight of 190.20 g/mol. Its IUPAC name is 2-(2-fluoroethylsulfonyl)pyrazine.

Molecular Properties

Compound Name2-(2-fluoroethylsulfonyl)pyrazine
PubChem CID130684185
Molecular FormulaC6H7FN2O2S
Molecular Weight190.20 g/mol
Exact Mass190.02
IUPAC Name2-(2-fluoroethylsulfonyl)pyrazine
SMILESO=S(=O)(CCF)c1cnccn1
InChIInChI=1S/C6H7FN2O2S/c7-1-4-12(10,11)6-5-8-2-3-9-6/h2-3,5H,1,4H2
InChIKeyJVRPXUPZXSISAO-UHFFFAOYSA-N
XLogP0.22
TPSA59.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 50.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoroethylsulfonyl)pyrazine?
The IUPAC name of 2-(2-fluoroethylsulfonyl)pyrazine (CID 130684185) is 2-(2-fluoroethylsulfonyl)pyrazine.
What is the SMILES notation for 2-(2-fluoroethylsulfonyl)pyrazine?
The canonical SMILES for 2-(2-fluoroethylsulfonyl)pyrazine is O=S(=O)(CCF)c1cnccn1.
What is the InChIKey of 2-(2-fluoroethylsulfonyl)pyrazine?
The InChIKey is JVRPXUPZXSISAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FN2O2S/c7-1-4-12(10,11)6-5-8-2-3-9-6/h2-3,5H,1,4H2.
What are the key properties of 2-(2-fluoroethylsulfonyl)pyrazine?
2-(2-fluoroethylsulfonyl)pyrazine has a molecular weight of 190.20 g/mol, XLogP of 0.22, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoroethylsulfonyl)pyrazine is sourced from PubChem (CID 130684185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).