2-methoxypyrazine

C5H6N2O — CID 18467

IUPAC2-methoxypyrazine
SMILESCOc1cnccn1
InChIInChI=1S/C5H6N2O/c1-8-5-4-6-2-3-7-5/h2-4H,1H3
InChIKeyWKSXRWSOSLGSTN-UHFFFAOYSA-N
MW110.12 g/mol
LogP0.49
Rot. Bonds1

About 2-methoxypyrazine

2-methoxypyrazine (PubChem CID 18467) has the molecular formula C5H6N2O and a molecular weight of 110.12 g/mol. Its IUPAC name is 2-methoxypyrazine.

Molecular Properties

Compound Name2-methoxypyrazine
PubChem CID18467
Molecular FormulaC5H6N2O
Molecular Weight110.12 g/mol
Exact Mass110.05
IUPAC Name2-methoxypyrazine
SMILESCOc1cnccn1
InChIInChI=1S/C5H6N2O/c1-8-5-4-6-2-3-7-5/h2-4H,1H3
InChIKeyWKSXRWSOSLGSTN-UHFFFAOYSA-N
XLogP0.49
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.12
LogP ≤ 50.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methoxy-(3 or 5 or 6)-isopropylpyrazine
CID 13256887
2-Ethoxypyrazine
CID 2758778
2(1H)-Pyrazinone, sodium salt (1:1)
CID 23668973
2-Iodo-3-methoxypyrazine
CID 10977417
2-Chloro-6-methoxypyrazine
CID 11018999
5-Bromo-2-iodo-3-methoxypyrazine
CID 11151182
2-Chloro-3-methoxypyrazine
CID 11804891
2-Bromo-5-methoxypyrazine
CID 19756172
2-(2-(Aziridin-1-yl)ethoxy)pyrazine
CID 268720
2-Butoxypyrazine
CID 19784221
2-Fluoro-6-methoxypyrazine
CID 11320944
3-Methoxypyrazine 1-oxide
CID 335278

Frequently Asked Questions

What is the IUPAC name of 2-methoxypyrazine?
The IUPAC name of 2-methoxypyrazine (CID 18467) is 2-methoxypyrazine.
What is the SMILES notation for 2-methoxypyrazine?
The canonical SMILES for 2-methoxypyrazine is COc1cnccn1.
What is the InChIKey of 2-methoxypyrazine?
The InChIKey is WKSXRWSOSLGSTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O/c1-8-5-4-6-2-3-7-5/h2-4H,1H3.
What are the key properties of 2-methoxypyrazine?
2-methoxypyrazine has a molecular weight of 110.12 g/mol, XLogP of 0.49, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxypyrazine is sourced from PubChem (CID 18467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).