8-methyl-2-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane

• ChemBase ID: 522918
• Molecular Formular: C14H25N3O2
• Molecular Mass: 267.3672
• Monoisotopic Mass: 267.19467706
• SMILES: C(=O)(N1CC2(CC1)CCN(CC2)C)N1CCOCC1
• Canonical SMILES: CN1CCC2(CC1)CCN(C2)C(=O)N1CCOCC1
• InChI: InChI=1S/C14H25N3O2/c1-15-5-2-14(3-6-15)4-7-17(12-14)13(18)16-8-10-19-11-9-16/h2-12H2,1H3
• InChIKey: GPEIORIVSWXVDV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 8-methyl-2-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane
• IUPAC Traditional name: 8-methyl-2-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane
• Synonyms: 8-methyl-2-(morpholin-4-ylcarbonyl)-2,8-diazaspiro[4.5]decane

CALCULATED PROPERTIES

JChem

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -3.5749612
• LogD (pH = 7.4): -2.071267
• Log P: -0.2957552
• Molar Refractivity: 74.7395 cm^3
• Polarizability: 28.90453 Å^3
• Polar Surface Area: 36.02 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

供应商提供(Chembridge)

• H Acceptors: 3
• H Donor: 0
• Log P: 0.89
• LOG S: -1.91
• Polar Surface Area: 36.02 Å^2
• Rotatable Bonds: 0