5,6,7,8-tetrahydroquinolin-5-amine

• ChemBase ID: 308570
• Molecular Formular: C9H12N2
• Molecular Mass: 148.20498
• Monoisotopic Mass: 148.10004839
• SMILES: c12c(nccc2)CCCC1N
• Canonical SMILES: NC1CCCc2c1cccn2
• InChI: InChI=1S/C9H12N2/c10-8-4-1-5-9-7(8)3-2-6-11-9/h2-3,6,8H,1,4-5,10H2
• InChIKey: ZMAFTVCNAYZLGF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5,6,7,8-tetrahydroquinolin-5-amine
• IUPAC Traditional name: 5,6,7,8-tetrahydroquinolin-5-amine
• Synonyms: 5,6,7,8-tetrahydro-5-quinolinamine

Database IDs

• CAS Number: 71569-15-8
• MDL Number: MFCD04038438

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -2.246544
• LogD (pH = 7.4): -1.2668504
• Log P: 0.7440507
• Molar Refractivity: 44.1325 cm^3
• Polarizability: 17.523827 Å^3
• Polar Surface Area: 38.91 Å^2