N'-(methylamino)ethanimidamide

• ChemBase ID: 268238
• Molecular Formular: C3H9N3
• Molecular Mass: 87.12366
• Monoisotopic Mass: 87.0796473
• SMILES: C(=N\NC)(\N)/C
• Canonical SMILES: CN/N=C(\N)/C
• InChI: InChI=1S/C3H9N3/c1-3(4)6-5-2/h5H,1-2H3,(H2,4,6)
• InChIKey: DCSHJYJZDMEKSG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N'-(methylamino)ethanimidamide
• IUPAC Traditional name: N'-(methylamino)ethanimidamide
• Synonyms: N'-(methylamino)ethanimidamide

Database IDs

• MDL Number: MFCD19160690
• PubChem SID: 164324148
• PubChem CID: 12530748

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -3.4423354
• LogD (pH = 7.4): -3.1120884
• Log P: -1.0332597
• Molar Refractivity: 35.4567 cm^3
• Polarizability: 9.547968 Å^3
• Polar Surface Area: 50.41 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -0.052

Product Information

• Purity: 95%