4-hydrazinyl-1-methyl-1,2-dihydroquinolin-2-one

• ChemBase ID: 310397
• Molecular Formular: C10H11N3O
• Molecular Mass: 189.21384
• Monoisotopic Mass: 189.09021199
• SMILES: c1(=O)cc(c2c(n1C)cccc2)NN
• Canonical SMILES: NNc1cc(=O)n(c2c1cccc2)C
• InChI: InChI=1S/C10H11N3O/c1-13-9-5-3-2-4-7(9)8(12-11)6-10(13)14/h2-6,12H,11H2,1H3
• InChIKey: ZYSGUISDGDUDLK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-hydrazinyl-1-methyl-1,2-dihydroquinolin-2-one
• IUPAC Traditional name: 4-hydrazinyl-1-methylquinolin-2-one
• Synonyms: 4-hydrazino-1-methylquinolin-2(1H)-one

Database IDs

• CAS Number: 192633-21-9
• MDL Number: MFCD02113369

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -0.16772793
• LogD (pH = 7.4): -0.11489181
• Log P: -0.11417481
• Molar Refractivity: 66.9218 cm^3
• Polarizability: 20.548304 Å^3
• Polar Surface Area: 58.36 Å^2