2-(methylsulfonylmethyl)quinoxaline

C10H10N2O2S — CID 57254192

IUPAC2-(methylsulfonylmethyl)quinoxaline
SMILESCS(=O)(=O)Cc1cnc2ccccc2n1
InChIInChI=1S/C10H10N2O2S/c1-15(13,14)7-8-6-11-9-4-2-3-5-10(9)12-8/h2-6H,7H2,1H3
InChIKeyJSOWPKYNENJGGJ-UHFFFAOYSA-N
MW222.27 g/mol
LogP1.17
Rot. Bonds2

About 2-(methylsulfonylmethyl)quinoxaline

2-(methylsulfonylmethyl)quinoxaline (PubChem CID 57254192) has the molecular formula C10H10N2O2S and a molecular weight of 222.27 g/mol. Its IUPAC name is 2-(methylsulfonylmethyl)quinoxaline.

Molecular Properties

Compound Name2-(methylsulfonylmethyl)quinoxaline
PubChem CID57254192
Molecular FormulaC10H10N2O2S
Molecular Weight222.27 g/mol
Exact Mass222.05
IUPAC Name2-(methylsulfonylmethyl)quinoxaline
SMILESCS(=O)(=O)Cc1cnc2ccccc2n1
InChIInChI=1S/C10H10N2O2S/c1-15(13,14)7-8-6-11-9-4-2-3-5-10(9)12-8/h2-6H,7H2,1H3
InChIKeyJSOWPKYNENJGGJ-UHFFFAOYSA-N
XLogP1.17
TPSA59.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.27
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-(methylsulfonylmethyl)quinoxaline?
The IUPAC name of 2-(methylsulfonylmethyl)quinoxaline (CID 57254192) is 2-(methylsulfonylmethyl)quinoxaline.
What is the SMILES notation for 2-(methylsulfonylmethyl)quinoxaline?
The canonical SMILES for 2-(methylsulfonylmethyl)quinoxaline is CS(=O)(=O)Cc1cnc2ccccc2n1.
What is the InChIKey of 2-(methylsulfonylmethyl)quinoxaline?
The InChIKey is JSOWPKYNENJGGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2S/c1-15(13,14)7-8-6-11-9-4-2-3-5-10(9)12-8/h2-6H,7H2,1H3.
What are the key properties of 2-(methylsulfonylmethyl)quinoxaline?
2-(methylsulfonylmethyl)quinoxaline has a molecular weight of 222.27 g/mol, XLogP of 1.17, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylsulfonylmethyl)quinoxaline is sourced from PubChem (CID 57254192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).