2-methoxy-6-methylsulfanylpyrazine

C6H8N2OS — CID 54342361

IUPAC2-methoxy-6-methylsulfanylpyrazine
SMILESCOc1cncc(SC)n1
InChIInChI=1S/C6H8N2OS/c1-9-5-3-7-4-6(8-5)10-2/h3-4H,1-2H3
InChIKeyGOLALXUSYJATAS-UHFFFAOYSA-N
MW156.21 g/mol
LogP1.21
Rot. Bonds2

About 2-methoxy-6-methylsulfanylpyrazine

2-methoxy-6-methylsulfanylpyrazine (PubChem CID 54342361) has the molecular formula C6H8N2OS and a molecular weight of 156.21 g/mol. Its IUPAC name is 2-methoxy-6-methylsulfanylpyrazine.

Molecular Properties

Compound Name2-methoxy-6-methylsulfanylpyrazine
PubChem CID54342361
Molecular FormulaC6H8N2OS
Molecular Weight156.21 g/mol
Exact Mass156.04
IUPAC Name2-methoxy-6-methylsulfanylpyrazine
SMILESCOc1cncc(SC)n1
InChIInChI=1S/C6H8N2OS/c1-9-5-3-7-4-6(8-5)10-2/h3-4H,1-2H3
InChIKeyGOLALXUSYJATAS-UHFFFAOYSA-N
XLogP1.21
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.21
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-methylsulfanylpyrazine?
The IUPAC name of 2-methoxy-6-methylsulfanylpyrazine (CID 54342361) is 2-methoxy-6-methylsulfanylpyrazine.
What is the SMILES notation for 2-methoxy-6-methylsulfanylpyrazine?
The canonical SMILES for 2-methoxy-6-methylsulfanylpyrazine is COc1cncc(SC)n1.
What is the InChIKey of 2-methoxy-6-methylsulfanylpyrazine?
The InChIKey is GOLALXUSYJATAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2OS/c1-9-5-3-7-4-6(8-5)10-2/h3-4H,1-2H3.
What are the key properties of 2-methoxy-6-methylsulfanylpyrazine?
2-methoxy-6-methylsulfanylpyrazine has a molecular weight of 156.21 g/mol, XLogP of 1.21, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-methylsulfanylpyrazine is sourced from PubChem (CID 54342361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).