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

• ChemBase ID: 248357
• Molecular Formular: C11H16N2O
• Molecular Mass: 192.25754
• Monoisotopic Mass: 192.12626314
• SMILES: c12c(nccc1OCC)C(N)CCC2
• Canonical SMILES: CCOc1ccnc2c1CCCC2N
• InChI: InChI=1S/C11H16N2O/c1-2-14-10-6-7-13-11-8(10)4-3-5-9(11)12/h6-7,9H,2-5,12H2,1H3
• InChIKey: HXRVJXAEXROYCL-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-ethoxy-5,6,7,8-tetrahydroquinolin-8-amine
• IUPAC Traditional name: 4-ethoxy-5,6,7,8-tetrahydroquinolin-8-amine
• Synonyms: 4-ethoxy-5,6,7,8-tetrahydroquinolin-8-amine

Database IDs

• PubChem SID: 164304267
• PubChem CID: 71758454

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -1.5333513
• LogD (pH = 7.4): -0.03594299
• Log P: 1.3029325
• Molar Refractivity: 55.321 cm^3
• Polarizability: 21.869982 Å^3
• Polar Surface Area: 48.14 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.519

Product Information

• Purity: null%