2-(2-hydrazinylethyl)-1-methylpyrrolidine

• ChemBase ID: 799619
• Molecular Formular: C7H17N3
• Molecular Mass: 143.22998
• Monoisotopic Mass: 143.14224756
• SMILES: N1(C(CCC1)CCNN)C
• Canonical SMILES: NNCCC1CCCN1C
• InChI: InChI=1S/C7H17N3/c1-10-6-2-3-7(10)4-5-9-8/h7,9H,2-6,8H2,1H3
• InChIKey: JPQJNPFGUBGAAU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(2-hydrazinylethyl)-1-methylpyrrolidine
• IUPAC Traditional name: 2-(2-hydrazinylethyl)-1-methylpyrrolidine
• Synonyms: 2-(2-hydrazinylethyl)-1-methylpyrrolidine

Database IDs

• CAS Number: 53242-81-2

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -3.8739285
• LogD (pH = 7.4): -2.9816775
• Log P: -0.2659455
• Molar Refractivity: 54.9914 cm^3
• Polarizability: 17.281263 Å^3
• Polar Surface Area: 41.29 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%