2-ethylsulfonylquinoxaline

C10H10N2O2S — CID 14342170

IUPAC2-ethylsulfonylquinoxaline
SMILESCCS(=O)(=O)c1cnc2ccccc2n1
InChIInChI=1S/C10H10N2O2S/c1-2-15(13,14)10-7-11-8-5-3-4-6-9(8)12-10/h3-7H,2H2,1H3
InChIKeyTZNOLAYNVGILDN-UHFFFAOYSA-N
MW222.27 g/mol
LogP1.42
Rot. Bonds2

About 2-ethylsulfonylquinoxaline

2-ethylsulfonylquinoxaline (PubChem CID 14342170) has the molecular formula C10H10N2O2S and a molecular weight of 222.27 g/mol. Its IUPAC name is 2-ethylsulfonylquinoxaline.

Molecular Properties

Compound Name2-ethylsulfonylquinoxaline
PubChem CID14342170
Molecular FormulaC10H10N2O2S
Molecular Weight222.27 g/mol
Exact Mass222.05
IUPAC Name2-ethylsulfonylquinoxaline
SMILESCCS(=O)(=O)c1cnc2ccccc2n1
InChIInChI=1S/C10H10N2O2S/c1-2-15(13,14)10-7-11-8-5-3-4-6-9(8)12-10/h3-7H,2H2,1H3
InChIKeyTZNOLAYNVGILDN-UHFFFAOYSA-N
XLogP1.42
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 ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethylsulfonylquinoxaline?
The IUPAC name of 2-ethylsulfonylquinoxaline (CID 14342170) is 2-ethylsulfonylquinoxaline.
What is the SMILES notation for 2-ethylsulfonylquinoxaline?
The canonical SMILES for 2-ethylsulfonylquinoxaline is CCS(=O)(=O)c1cnc2ccccc2n1.
What is the InChIKey of 2-ethylsulfonylquinoxaline?
The InChIKey is TZNOLAYNVGILDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2S/c1-2-15(13,14)10-7-11-8-5-3-4-6-9(8)12-10/h3-7H,2H2,1H3.
What are the key properties of 2-ethylsulfonylquinoxaline?
2-ethylsulfonylquinoxaline has a molecular weight of 222.27 g/mol, XLogP of 1.42, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylsulfonylquinoxaline is sourced from PubChem (CID 14342170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).