4-methyl-1H-pyrazin-2-amine

C5H9N3 — CID 22046305

IUPAC4-methyl-1H-pyrazin-2-amine
SMILESCN1C=CNC(N)=C1
InChIInChI=1S/C5H9N3/c1-8-3-2-7-5(6)4-8/h2-4,7H,6H2,1H3
InChIKeyCEXPXNQEHWFEFA-UHFFFAOYSA-N
MW111.15 g/mol
LogP-0.25
Rot. Bonds

About 4-methyl-1H-pyrazin-2-amine

4-methyl-1H-pyrazin-2-amine (PubChem CID 22046305) has the molecular formula C5H9N3 and a molecular weight of 111.15 g/mol. Its IUPAC name is 4-methyl-1H-pyrazin-2-amine.

Molecular Properties

Compound Name4-methyl-1H-pyrazin-2-amine
PubChem CID22046305
Molecular FormulaC5H9N3
Molecular Weight111.15 g/mol
Exact Mass111.08
IUPAC Name4-methyl-1H-pyrazin-2-amine
SMILESCN1C=CNC(N)=C1
InChIInChI=1S/C5H9N3/c1-8-3-2-7-5(6)4-8/h2-4,7H,6H2,1H3
InChIKeyCEXPXNQEHWFEFA-UHFFFAOYSA-N
XLogP-0.25
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.15
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1H-pyrazin-2-amine?
The IUPAC name of 4-methyl-1H-pyrazin-2-amine (CID 22046305) is 4-methyl-1H-pyrazin-2-amine.
What is the SMILES notation for 4-methyl-1H-pyrazin-2-amine?
The canonical SMILES for 4-methyl-1H-pyrazin-2-amine is CN1C=CNC(N)=C1.
What is the InChIKey of 4-methyl-1H-pyrazin-2-amine?
The InChIKey is CEXPXNQEHWFEFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3/c1-8-3-2-7-5(6)4-8/h2-4,7H,6H2,1H3.
What are the key properties of 4-methyl-1H-pyrazin-2-amine?
4-methyl-1H-pyrazin-2-amine has a molecular weight of 111.15 g/mol, XLogP of -0.25, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1H-pyrazin-2-amine is sourced from PubChem (CID 22046305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).