N-[1-(methoxymethyl)cyclopentyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide

• ChemBase ID: 677883
• Molecular Formular: C12H20N2O4
• Molecular Mass: 256.2982
• Monoisotopic Mass: 256.14230713
• SMILES: C1(=O)N(CC(=O)NC2(COC)CCCC2)CCO1
• Canonical SMILES: COCC1(CCCC1)NC(=O)CN1CCOC1=O
• InChI: InChI=1S/C12H20N2O4/c1-17-9-12(4-2-3-5-12)13-10(15)8-14-6-7-18-11(14)16/h2-9H2,1H3,(H,13,15)
• InChIKey: AGKKKFDMUZUWSP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-[1-(methoxymethyl)cyclopentyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
• IUPAC Traditional name: N-[1-(methoxymethyl)cyclopentyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
• Synonyms: N-[1-(methoxymethyl)cyclopentyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide

CALCULATED PROPERTIES

JChem

• Acid pKa: 13.533316
• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -0.008958177
• LogD (pH = 7.4): -0.008958455
• Log P: -0.008958172
• Molar Refractivity: 64.0637 cm^3
• Polarizability: 25.272545 Å^3
• Polar Surface Area: 67.87 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

供应商提供(Chembridge)

• H Acceptors: 4
• H Donor: 1
• Log P: -0.2
• LOG S: -2.21
• Polar Surface Area: 67.87 Å^2
• Rotatable Bonds: 5