diaziridine

• ChemBase ID: 126949
• Molecular Formular: CH4N2
• Molecular Mass: 44.05586
• Monoisotopic Mass: 44.03744814
• SMILES: C1NN1
• Canonical SMILES: N1NC1
• InChI: InChI=1S/CH4N2/c1-2-3-1/h2-3H,1H2
• InChIKey: DIXBSCZRIZDQGC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: diaziridine
• IUPAC Traditional name: diaziridine
• Synonyms: Diaziridine

Database IDs

• PubChem SID: 162221275
• PubChem CID: 5059686
• Wikipedia Title: Diaziridine

CALCULATED PROPERTIES

• Acid pKa: 16.313917
• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -0.6479681
• LogD (pH = 7.4): -0.64786357
• Log P: -0.6478622
• Molar Refractivity: 32.0637 cm^3
• Polarizability: 4.69935 Å^3
• Polar Surface Area: 33.97 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true