2-methyl-N'-(methylamino)propanimidamide

• ChemBase ID: 268270
• Molecular Formular: C5H13N3
• Molecular Mass: 115.17682
• Monoisotopic Mass: 115.11094743
• SMILES: C(=N\NC)(\N)/C(C)C
• Canonical SMILES: CN/N=C(/C(C)C)\N
• InChI: InChI=1S/C5H13N3/c1-4(2)5(6)8-7-3/h4,7H,1-3H3,(H2,6,8)
• InChIKey: MGDUWYMRDCVSKN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-methyl-N'-(methylamino)propanimidamide
• IUPAC Traditional name: 2-methyl-N'-(methylamino)propanimidamide
• Synonyms: 2-methyl-N'-(methylamino)propanimidamide

Database IDs

• MDL Number: MFCD19160612
• PubChem SID: 164324180
• PubChem CID: 71758731

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -2.1982722
• LogD (pH = 7.4): -1.8490894
• Log P: 0.21026234
• Molar Refractivity: 44.6581 cm^3
• Polarizability: 13.227769 Å^3
• Polar Surface Area: 50.41 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.786

Product Information

• Purity: 95%