2-methyl-6-(3-methylbutyl)pyrazine

C10H16N2 — CID 572730

IUPAC2-methyl-6-(3-methylbutyl)pyrazine
SMILESCc1cncc(CCC(C)C)n1
InChIInChI=1S/C10H16N2/c1-8(2)4-5-10-7-11-6-9(3)12-10/h6-8H,4-5H2,1-3H3
InChIKeyOESNKUIGZMJYKH-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.37
Rot. Bonds3

About 2-methyl-6-(3-methylbutyl)pyrazine

2-methyl-6-(3-methylbutyl)pyrazine (PubChem CID 572730) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 2-methyl-6-(3-methylbutyl)pyrazine.

Molecular Properties

Compound Name2-methyl-6-(3-methylbutyl)pyrazine
PubChem CID572730
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name2-methyl-6-(3-methylbutyl)pyrazine
SMILESCc1cncc(CCC(C)C)n1
InChIInChI=1S/C10H16N2/c1-8(2)4-5-10-7-11-6-9(3)12-10/h6-8H,4-5H2,1-3H3
InChIKeyOESNKUIGZMJYKH-UHFFFAOYSA-N
XLogP2.37
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(3-methylbutyl)pyrazine?
The IUPAC name of 2-methyl-6-(3-methylbutyl)pyrazine (CID 572730) is 2-methyl-6-(3-methylbutyl)pyrazine.
What is the SMILES notation for 2-methyl-6-(3-methylbutyl)pyrazine?
The canonical SMILES for 2-methyl-6-(3-methylbutyl)pyrazine is Cc1cncc(CCC(C)C)n1.
What is the InChIKey of 2-methyl-6-(3-methylbutyl)pyrazine?
The InChIKey is OESNKUIGZMJYKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-8(2)4-5-10-7-11-6-9(3)12-10/h6-8H,4-5H2,1-3H3.
What are the key properties of 2-methyl-6-(3-methylbutyl)pyrazine?
2-methyl-6-(3-methylbutyl)pyrazine has a molecular weight of 164.25 g/mol, XLogP of 2.37, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(3-methylbutyl)pyrazine is sourced from PubChem (CID 572730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).