2,5-dimethylpyrazine;2-methylpyrazine;pyrazine

C15H18N6 — CID 175316649

IUPAC2,5-dimethylpyrazine;2-methylpyrazine;pyrazine
SMILESCc1cnc(C)cn1.Cc1cnccn1.c1cnccn1
InChIInChI=1S/C6H8N2.C5H6N2.C4H4N2/c1-5-3-8-6(2)4-7-5;1-5-4-6-2-3-7-5;1-2-6-4-3-5-1/h3-4H,1-2H3;2-4H,1H3;1-4H
InChIKeyNXZSYGGSOPQSOU-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.36
Rot. Bonds

About 2,5-dimethylpyrazine;2-methylpyrazine;pyrazine

2,5-dimethylpyrazine;2-methylpyrazine;pyrazine (PubChem CID 175316649) has the molecular formula C15H18N6 and a molecular weight of 282.35 g/mol. Its IUPAC name is 2,5-dimethylpyrazine;2-methylpyrazine;pyrazine.

Molecular Properties

Compound Name2,5-dimethylpyrazine;2-methylpyrazine;pyrazine
PubChem CID175316649
Molecular FormulaC15H18N6
Molecular Weight282.35 g/mol
Exact Mass282.16
IUPAC Name2,5-dimethylpyrazine;2-methylpyrazine;pyrazine
SMILESCc1cnc(C)cn1.Cc1cnccn1.c1cnccn1
InChIInChI=1S/C6H8N2.C5H6N2.C4H4N2/c1-5-3-8-6(2)4-7-5;1-5-4-6-2-3-7-5;1-2-6-4-3-5-1/h3-4H,1-2H3;2-4H,1H3;1-4H
InChIKeyNXZSYGGSOPQSOU-UHFFFAOYSA-N
XLogP2.36
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethylpyrazine;2-methylpyrazine;pyrazine?
The IUPAC name of 2,5-dimethylpyrazine;2-methylpyrazine;pyrazine (CID 175316649) is 2,5-dimethylpyrazine;2-methylpyrazine;pyrazine.
What is the SMILES notation for 2,5-dimethylpyrazine;2-methylpyrazine;pyrazine?
The canonical SMILES for 2,5-dimethylpyrazine;2-methylpyrazine;pyrazine is Cc1cnc(C)cn1.Cc1cnccn1.c1cnccn1.
What is the InChIKey of 2,5-dimethylpyrazine;2-methylpyrazine;pyrazine?
The InChIKey is NXZSYGGSOPQSOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2.C5H6N2.C4H4N2/c1-5-3-8-6(2)4-7-5;1-5-4-6-2-3-7-5;1-2-6-4-3-5-1/h3-4H,1-2H3;2-4H,1H3;1-4H.
What are the key properties of 2,5-dimethylpyrazine;2-methylpyrazine;pyrazine?
2,5-dimethylpyrazine;2-methylpyrazine;pyrazine has a molecular weight of 282.35 g/mol, XLogP of 2.36, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethylpyrazine;2-methylpyrazine;pyrazine is sourced from PubChem (CID 175316649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).