N-aminopyrazine-2-carboximidamide

• ChemBase ID: 86774
• Molecular Formular: C5H7N5
• Molecular Mass: 137.14258
• Monoisotopic Mass: 137.07014525
• SMILES: n1c(cncc1)C(=N)NN
• Canonical SMILES: NNC(=N)c1cnccn1
• InChI: InChI=1S/C5H7N5/c6-5(10-7)4-3-8-1-2-9-4/h1-3H,7H2,(H2,6,10)
• InChIKey: JNVGYAKLZAAYHJ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-aminopyrazine-2-carboximidamide
• IUPAC Traditional name: N-aminopyrazine-2-carboximidamide
• Synonyms: pyrazine-2-carboximidohydrazide

Database IDs

• MDL Number: MFCD00833100
• PubChem SID: 162073890
• PubChem CID: 9583164

CALCULATED PROPERTIES

• H Acceptors: 5
• H Donor: 3
• LogD (pH = 5.5): -2.1554456
• LogD (pH = 7.4): -1.4134438
• Log P: -1.3874226
• Molar Refractivity: 58.0216 cm^3
• Polarizability: 13.681907 Å^3
• Polar Surface Area: 87.68 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true