2-methoxy-3,5-dimethylpyrazine

C7H10N2O — CID 6429218

IUPAC2-methoxy-3,5-dimethylpyrazine
SMILESCOc1ncc(C)nc1C
InChIInChI=1S/C7H10N2O/c1-5-4-8-7(10-3)6(2)9-5/h4H,1-3H3
InChIKeyBXKLSVWRSUPMBO-UHFFFAOYSA-N
MW138.17 g/mol
LogP1.10
Rot. Bonds1

About 2-methoxy-3,5-dimethylpyrazine

2-methoxy-3,5-dimethylpyrazine (PubChem CID 6429218) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 2-methoxy-3,5-dimethylpyrazine.

Molecular Properties

Compound Name2-methoxy-3,5-dimethylpyrazine
PubChem CID6429218
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name2-methoxy-3,5-dimethylpyrazine
SMILESCOc1ncc(C)nc1C
InChIInChI=1S/C7H10N2O/c1-5-4-8-7(10-3)6(2)9-5/h4H,1-3H3
InChIKeyBXKLSVWRSUPMBO-UHFFFAOYSA-N
XLogP1.10
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-3,5-dimethylpyrazine?
The IUPAC name of 2-methoxy-3,5-dimethylpyrazine (CID 6429218) is 2-methoxy-3,5-dimethylpyrazine.
What is the SMILES notation for 2-methoxy-3,5-dimethylpyrazine?
The canonical SMILES for 2-methoxy-3,5-dimethylpyrazine is COc1ncc(C)nc1C.
What is the InChIKey of 2-methoxy-3,5-dimethylpyrazine?
The InChIKey is BXKLSVWRSUPMBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-5-4-8-7(10-3)6(2)9-5/h4H,1-3H3.
What are the key properties of 2-methoxy-3,5-dimethylpyrazine?
2-methoxy-3,5-dimethylpyrazine has a molecular weight of 138.17 g/mol, XLogP of 1.10, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3,5-dimethylpyrazine is sourced from PubChem (CID 6429218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).