2-iodo-6-methylpyridin-3-amine

• ChemBase ID: 799763
• Molecular Formular: C6H7IN2
• Molecular Mass: 234.03765
• Monoisotopic Mass: 233.96539623
• SMILES: n1c(c(ccc1C)N)I
• Canonical SMILES: Cc1ccc(c(n1)I)N
• InChI: InChI=1S/C6H7IN2/c1-4-2-3-5(8)6(7)9-4/h2-3H,8H2,1H3
• InChIKey: OIBYNWSTLSCBDU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-iodo-6-methylpyridin-3-amine
• IUPAC Traditional name: 2-iodo-6-methylpyridin-3-amine
• Synonyms: 2-iodo-6-methylpyridin-3-amine

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 1.0188372
• LogD (pH = 7.4): 1.0195408
• Log P: 1.0195497
• Molar Refractivity: 46.2636 cm^3
• Polarizability: 17.645136 Å^3
• Polar Surface Area: 38.91 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 97%