2-methylsulfinylquinoxaline

C9H8N2OS — CID 11344534

IUPAC2-methylsulfinylquinoxaline
SMILESCS(=O)c1cnc2ccccc2n1
InChIInChI=1S/C9H8N2OS/c1-13(12)9-6-10-7-4-2-3-5-8(7)11-9/h2-6H,1H3
InChIKeyIZQFUWVKFZJQIC-UHFFFAOYSA-N
MW192.24 g/mol
LogP1.37
Rot. Bonds1

About 2-methylsulfinylquinoxaline

2-methylsulfinylquinoxaline (PubChem CID 11344534) has the molecular formula C9H8N2OS and a molecular weight of 192.24 g/mol. Its IUPAC name is 2-methylsulfinylquinoxaline.

Molecular Properties

Compound Name2-methylsulfinylquinoxaline
PubChem CID11344534
Molecular FormulaC9H8N2OS
Molecular Weight192.24 g/mol
Exact Mass192.04
IUPAC Name2-methylsulfinylquinoxaline
SMILESCS(=O)c1cnc2ccccc2n1
InChIInChI=1S/C9H8N2OS/c1-13(12)9-6-10-7-4-2-3-5-8(7)11-9/h2-6H,1H3
InChIKeyIZQFUWVKFZJQIC-UHFFFAOYSA-N
XLogP1.37
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methylsulfinylquinoxaline?
The IUPAC name of 2-methylsulfinylquinoxaline (CID 11344534) is 2-methylsulfinylquinoxaline.
What is the SMILES notation for 2-methylsulfinylquinoxaline?
The canonical SMILES for 2-methylsulfinylquinoxaline is CS(=O)c1cnc2ccccc2n1.
What is the InChIKey of 2-methylsulfinylquinoxaline?
The InChIKey is IZQFUWVKFZJQIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS/c1-13(12)9-6-10-7-4-2-3-5-8(7)11-9/h2-6H,1H3.
What are the key properties of 2-methylsulfinylquinoxaline?
2-methylsulfinylquinoxaline has a molecular weight of 192.24 g/mol, XLogP of 1.37, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylsulfinylquinoxaline is sourced from PubChem (CID 11344534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).