2-fluoro-3-methylsulfonylquinoxaline

C9H7FN2O2S — CID 151892035

IUPAC2-fluoro-3-methylsulfonylquinoxaline
SMILESCS(=O)(=O)c1nc2ccccc2nc1F
InChIInChI=1S/C9H7FN2O2S/c1-15(13,14)9-8(10)11-6-4-2-3-5-7(6)12-9/h2-5H,1H3
InChIKeySQXWAJVPUWVBGI-UHFFFAOYSA-N
MW226.23 g/mol
LogP1.17
Rot. Bonds1

About 2-fluoro-3-methylsulfonylquinoxaline

2-fluoro-3-methylsulfonylquinoxaline (PubChem CID 151892035) has the molecular formula C9H7FN2O2S and a molecular weight of 226.23 g/mol. Its IUPAC name is 2-fluoro-3-methylsulfonylquinoxaline.

Molecular Properties

Compound Name2-fluoro-3-methylsulfonylquinoxaline
PubChem CID151892035
Molecular FormulaC9H7FN2O2S
Molecular Weight226.23 g/mol
Exact Mass226.02
IUPAC Name2-fluoro-3-methylsulfonylquinoxaline
SMILESCS(=O)(=O)c1nc2ccccc2nc1F
InChIInChI=1S/C9H7FN2O2S/c1-15(13,14)9-8(10)11-6-4-2-3-5-7(6)12-9/h2-5H,1H3
InChIKeySQXWAJVPUWVBGI-UHFFFAOYSA-N
XLogP1.17
TPSA59.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.23
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-methylsulfonylquinoxaline?
The IUPAC name of 2-fluoro-3-methylsulfonylquinoxaline (CID 151892035) is 2-fluoro-3-methylsulfonylquinoxaline.
What is the SMILES notation for 2-fluoro-3-methylsulfonylquinoxaline?
The canonical SMILES for 2-fluoro-3-methylsulfonylquinoxaline is CS(=O)(=O)c1nc2ccccc2nc1F.
What is the InChIKey of 2-fluoro-3-methylsulfonylquinoxaline?
The InChIKey is SQXWAJVPUWVBGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7FN2O2S/c1-15(13,14)9-8(10)11-6-4-2-3-5-7(6)12-9/h2-5H,1H3.
What are the key properties of 2-fluoro-3-methylsulfonylquinoxaline?
2-fluoro-3-methylsulfonylquinoxaline has a molecular weight of 226.23 g/mol, XLogP of 1.17, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-methylsulfonylquinoxaline is sourced from PubChem (CID 151892035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).