5-amino-6-methylpyrazine-2,3-dicarbonitrile

C7H5N5 — CID 71440315

IUPAC5-amino-6-methylpyrazine-2,3-dicarbonitrile
SMILESCc1nc(C#N)c(C#N)nc1N
InChIInChI=1S/C7H5N5/c1-4-7(10)12-6(3-9)5(2-8)11-4/h1H3,(H2,10,12)
InChIKeyZOJYZNITKWHVBU-UHFFFAOYSA-N
MW159.15 g/mol
LogP0.11
Rot. Bonds

About 5-amino-6-methylpyrazine-2,3-dicarbonitrile

5-amino-6-methylpyrazine-2,3-dicarbonitrile (PubChem CID 71440315) has the molecular formula C7H5N5 and a molecular weight of 159.15 g/mol. Its IUPAC name is 5-amino-6-methylpyrazine-2,3-dicarbonitrile.

Molecular Properties

Compound Name5-amino-6-methylpyrazine-2,3-dicarbonitrile
PubChem CID71440315
Molecular FormulaC7H5N5
Molecular Weight159.15 g/mol
Exact Mass159.05
IUPAC Name5-amino-6-methylpyrazine-2,3-dicarbonitrile
SMILESCc1nc(C#N)c(C#N)nc1N
InChIInChI=1S/C7H5N5/c1-4-7(10)12-6(3-9)5(2-8)11-4/h1H3,(H2,10,12)
InChIKeyZOJYZNITKWHVBU-UHFFFAOYSA-N
XLogP0.11
TPSA99.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.15
LogP ≤ 50.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-amino-6-methylpyrazine-2,3-dicarbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-methylpyrazine-2,3-dicarbonitrile?
The IUPAC name of 5-amino-6-methylpyrazine-2,3-dicarbonitrile (CID 71440315) is 5-amino-6-methylpyrazine-2,3-dicarbonitrile.
What is the SMILES notation for 5-amino-6-methylpyrazine-2,3-dicarbonitrile?
The canonical SMILES for 5-amino-6-methylpyrazine-2,3-dicarbonitrile is Cc1nc(C#N)c(C#N)nc1N.
What is the InChIKey of 5-amino-6-methylpyrazine-2,3-dicarbonitrile?
The InChIKey is ZOJYZNITKWHVBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5N5/c1-4-7(10)12-6(3-9)5(2-8)11-4/h1H3,(H2,10,12).
What are the key properties of 5-amino-6-methylpyrazine-2,3-dicarbonitrile?
5-amino-6-methylpyrazine-2,3-dicarbonitrile has a molecular weight of 159.15 g/mol, XLogP of 0.11, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-methylpyrazine-2,3-dicarbonitrile is sourced from PubChem (CID 71440315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).