2-(propan-2-yl)-2,6-diazaspiro[3.3]heptane

• ChemBase ID: 309184
• Molecular Formular: C8H16N2
• Molecular Mass: 140.22604
• Monoisotopic Mass: 140.13134852
• SMILES: N1(CC2(C1)CNC2)C(C)C
• Canonical SMILES: CC(N1CC2(C1)CNC2)C
• InChI: InChI=1S/C8H16N2/c1-7(2)10-5-8(6-10)3-9-4-8/h7,9H,3-6H2,1-2H3
• InChIKey: OJCXCNAXUUGKLW-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(propan-2-yl)-2,6-diazaspiro[3.3]heptane
• IUPAC Traditional name: 2-isopropyl-2,6-diazaspiro[3.3]heptane
• Synonyms: 2-isopropyl-2,6-diazaspiro[3.3]heptane

CALCULATED PROPERTIES

• Polar Surface Area: 15.27 Å^2
• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -4.180347
• LogD (pH = 7.4): -2.5908344
• Log P: 0.10639574
• Molar Refractivity: 42.5314 cm^3
• Polarizability: 17.072641 Å^3