2,4-dimethylpyrimidine-5-carbohydrazide

• ChemBase ID: 309698
• Molecular Formular: C7H10N4O
• Molecular Mass: 166.1805
• Monoisotopic Mass: 166.08546096
• SMILES: c1(c(nc(nc1)C)C)C(=O)NN
• Canonical SMILES: NNC(=O)c1cnc(nc1C)C
• InChI: InChI=1S/C7H10N4O/c1-4-6(7(12)11-8)3-9-5(2)10-4/h3H,8H2,1-2H3,(H,11,12)
• InChIKey: LTDPWGOVAVFNIU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,4-dimethylpyrimidine-5-carbohydrazide
• IUPAC Traditional name: 2,4-dimethylpyrimidine-5-carbohydrazide
• Synonyms: 2,4-dimethyl-5-pyrimidinecarbohydrazide

Database IDs

• MDL Number: MFCD18917043

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): -0.6305924
• LogD (pH = 7.4): -0.6298785
• Log P: -0.6298685
• Molar Refractivity: 45.5007 cm^3
• Polarizability: 16.374626 Å^3
• Polar Surface Area: 80.9 Å^2