N,6-dimethylpyrazin-2-amine

• ChemBase ID: 293204
• Molecular Formular: C6H9N3
• Molecular Mass: 123.15576
• Monoisotopic Mass: 123.0796473
• SMILES: Cc1cncc(NC)n1
• Canonical SMILES: CNc1cncc(n1)C
• InChI: InChI=1S/C6H9N3/c1-5-3-8-4-6(7-2)9-5/h3-4H,1-2H3,(H,7,9)
• InChIKey: FOOAQEILGQDHDP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N,6-dimethylpyrazin-2-amine
• IUPAC Traditional name: N,6-dimethylpyrazin-2-amine
• Synonyms: N,6-Dimethylpyrazin-2-amine

Database IDs

• CAS Number: 89464-78-8
• MDL Number: MFCD19221376
• PubChem SID: 180678735
• PubChem CID: 55286460

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -0.26456323
• LogD (pH = 7.4): -0.2635067
• Log P: -0.2634932
• Molar Refractivity: 36.843 cm^3
• Polarizability: 13.281484 Å^3
• Polar Surface Area: 37.81 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%; 97%