tert-butyl (1R,3R,5S)-8-azaspiro[bicyclo[3.2.1]octane-3,2'-morpholine]-8-carboxylate

• ChemBase ID: 310141
• Molecular Formular: C15H26N2O3
• Molecular Mass: 282.37854
• Monoisotopic Mass: 282.1943427
• SMILES: C(=O)(N1[C@@H]2C[C@]3(C[C@H]1CC2)OCCNC3)OC(C)(C)C
• Canonical SMILES: O=C(N1[C@@H]2CC[C@H]1C[C@@]1(C2)CNCCO1)OC(C)(C)C
• InChI: InChI=1S/C15H26N2O3/c1-14(2,3)20-13(18)17-11-4-5-12(17)9-15(8-11)10-16-6-7-19-15/h11-12,16H,4-10H2,1-3H3/t11-,12+,15+
• InChIKey: SWXVOKDTXKRXKI-JYAVWHMHSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tert-butyl (1R,3R,5S)-8-azaspiro[bicyclo[3.2.1]octane-3,2'-morpholine]-8-carboxylate
• IUPAC Traditional name: tert-butyl (1R,3R,5S)-8-azaspiro[bicyclo[3.2.1]octane-3,2'-morpholine]-8-carboxylate
• Synonyms: tert-butyl rac-(1R,3r,5S)-8H-spiro[8-azabicyclo[3.2.1]octane-3,2'-[1,4]oxazinane]-8-carboxylate

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -1.8228313
• LogD (pH = 7.4): -0.14214125
• Log P: 0.9646726
• Molar Refractivity: 75.6904 cm^3
• Polarizability: 30.307463 Å^3
• Polar Surface Area: 50.8 Å^2