2-(1-methoxy-2-methylpropyl)pyrazine

C9H14N2O — CID 54145268

IUPAC2-(1-methoxy-2-methylpropyl)pyrazine
SMILESCOC(c1cnccn1)C(C)C
InChIInChI=1S/C9H14N2O/c1-7(2)9(12-3)8-6-10-4-5-11-8/h4-7,9H,1-3H3
InChIKeyODXWVXATGXKGDG-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.82
Rot. Bonds3

About 2-(1-methoxy-2-methylpropyl)pyrazine

2-(1-methoxy-2-methylpropyl)pyrazine (PubChem CID 54145268) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 2-(1-methoxy-2-methylpropyl)pyrazine.

Molecular Properties

Compound Name2-(1-methoxy-2-methylpropyl)pyrazine
PubChem CID54145268
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name2-(1-methoxy-2-methylpropyl)pyrazine
SMILESCOC(c1cnccn1)C(C)C
InChIInChI=1S/C9H14N2O/c1-7(2)9(12-3)8-6-10-4-5-11-8/h4-7,9H,1-3H3
InChIKeyODXWVXATGXKGDG-UHFFFAOYSA-N
XLogP1.82
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxy-2-methylpropyl)pyrazine?
The IUPAC name of 2-(1-methoxy-2-methylpropyl)pyrazine (CID 54145268) is 2-(1-methoxy-2-methylpropyl)pyrazine.
What is the SMILES notation for 2-(1-methoxy-2-methylpropyl)pyrazine?
The canonical SMILES for 2-(1-methoxy-2-methylpropyl)pyrazine is COC(c1cnccn1)C(C)C.
What is the InChIKey of 2-(1-methoxy-2-methylpropyl)pyrazine?
The InChIKey is ODXWVXATGXKGDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-7(2)9(12-3)8-6-10-4-5-11-8/h4-7,9H,1-3H3.
What are the key properties of 2-(1-methoxy-2-methylpropyl)pyrazine?
2-(1-methoxy-2-methylpropyl)pyrazine has a molecular weight of 166.22 g/mol, XLogP of 1.82, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxy-2-methylpropyl)pyrazine is sourced from PubChem (CID 54145268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).