2,3-dihydro-1H-indol-5-amine

• ChemBase ID: 306472
• Molecular Formular: C8H10N2
• Molecular Mass: 134.1784
• Monoisotopic Mass: 134.08439833
• SMILES: c12c(cc(N)cc2)CCN1
• Canonical SMILES: Nc1ccc2c(c1)CCN2
• InChI: InChI=1S/C8H10N2/c9-7-1-2-8-6(5-7)3-4-10-8/h1-2,5,10H,3-4,9H2
• InChIKey: CNSBIJRLKLHUIQ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,3-dihydro-1H-indol-5-amine
• IUPAC Traditional name: 2,3-dihydro-1H-indol-5-amine
• Synonyms: indolin-5-amine

Database IDs

• CAS Number: 32692-19-6
• MDL Number: MFCD09035713

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -0.4609267
• LogD (pH = 7.4): 0.59336364
• Log P: 0.6569865
• Molar Refractivity: 44.2618 cm^3
• Polarizability: 15.486745 Å^3
• Polar Surface Area: 38.05 Å^2