2-methyl-6-methylsulfanylpyrazine

C6H8N2S — CID 520398

IUPAC2-methyl-6-methylsulfanylpyrazine
SMILESCSc1cncc(C)n1
InChIInChI=1S/C6H8N2S/c1-5-3-7-4-6(8-5)9-2/h3-4H,1-2H3
InChIKeyUWZQTYQYHJLIRS-UHFFFAOYSA-N
MW140.21 g/mol
LogP1.51
Rot. Bonds1

About 2-methyl-6-methylsulfanylpyrazine

2-methyl-6-methylsulfanylpyrazine (PubChem CID 520398) has the molecular formula C6H8N2S and a molecular weight of 140.21 g/mol. Its IUPAC name is 2-methyl-6-methylsulfanylpyrazine.

Molecular Properties

Compound Name2-methyl-6-methylsulfanylpyrazine
PubChem CID520398
Molecular FormulaC6H8N2S
Molecular Weight140.21 g/mol
Exact Mass140.04
IUPAC Name2-methyl-6-methylsulfanylpyrazine
SMILESCSc1cncc(C)n1
InChIInChI=1S/C6H8N2S/c1-5-3-7-4-6(8-5)9-2/h3-4H,1-2H3
InChIKeyUWZQTYQYHJLIRS-UHFFFAOYSA-N
XLogP1.51
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.21
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-methylsulfanylpyrazine?
The IUPAC name of 2-methyl-6-methylsulfanylpyrazine (CID 520398) is 2-methyl-6-methylsulfanylpyrazine.
What is the SMILES notation for 2-methyl-6-methylsulfanylpyrazine?
The canonical SMILES for 2-methyl-6-methylsulfanylpyrazine is CSc1cncc(C)n1.
What is the InChIKey of 2-methyl-6-methylsulfanylpyrazine?
The InChIKey is UWZQTYQYHJLIRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2S/c1-5-3-7-4-6(8-5)9-2/h3-4H,1-2H3.
What are the key properties of 2-methyl-6-methylsulfanylpyrazine?
2-methyl-6-methylsulfanylpyrazine has a molecular weight of 140.21 g/mol, XLogP of 1.51, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-methylsulfanylpyrazine is sourced from PubChem (CID 520398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).