2-(4-methylpiperazin-1-yl)acetohydrazide

• ChemBase ID: 309062
• Molecular Formular: C7H16N4O
• Molecular Mass: 172.22814
• Monoisotopic Mass: 172.13241115
• SMILES: C(=O)(CN1CCN(CC1)C)NN
• Canonical SMILES: NNC(=O)CN1CCN(CC1)C
• InChI: InChI=1S/C7H16N4O/c1-10-2-4-11(5-3-10)6-7(12)9-8/h2-6,8H2,1H3,(H,9,12)
• InChIKey: FNXGWGAOSHYTSX-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(4-methylpiperazin-1-yl)acetohydrazide
• IUPAC Traditional name: 2-(4-methylpiperazin-1-yl)acetohydrazide
• Synonyms: 2-(4-methyl-1-piperazinyl)acetohydrazide

Database IDs

• CAS Number: 24632-44-8
• MDL Number: MFCD01237569

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): -3.698161
• LogD (pH = 7.4): -2.01418
• Log P: -1.588146
• Molar Refractivity: 48.4291 cm^3
• Polarizability: 18.591217 Å^3
• Polar Surface Area: 61.6 Å^2