2-[2-oxo(2H6)pyrrolidin-1-yl](2H2)acetamide

• ChemBase编号: 176476
• 分子式: C6H10N2O2
• 平均质量: 142.1558
• 单一同位素质量: 142.07422757
• SMILES: C1CN(C(=O)C1)CC(=O)N
• Canonical SMILES: NC(=O)CN1CCCC1=O
• InChI: InChI=1S/C6H10N2O2/c7-5(9)4-8-3-1-2-6(8)10/h1-4H2,(H2,7,9)
• InChIKey: GMZVRMREEHBGGF-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 2-[2-oxo(^2H₆)pyrrolidin-1-yl](^2H₂)acetamide
• IUPAC传统名: 2-[2-oxo(^2H₆)pyrrolidin-1-yl](^2H₂)acetamide
• 别名: 2-Oxo-1-pyrrolidineacetamide-d8; (2-Oxopyrrolidino)acetamide-d8; 2-(2-Oxopyrrolidin-1-yl)acetamide-d8; Avigilen-d8; Axonyl-d8; Cerebroforte-d8; Piramem-d8; Pyracetam-d8; UCB 6215-d8; Piracetam-d8

登记号

• PubChem SID: 164232386
• PubChem CID: 71751579

理论计算性质

• 极化表面积: 63.4 Å^2
• 可自由旋转的化学键: 2
• 里宾斯基五规则: true
• 摩尔折射率: 35.0614 cm^3
• 极化性: 13.547892 Å^3
• Acid pKa: 15.934727
• 质子受体: 2
• 质子供体: 1
• LogD (pH = 5.5): -1.6848925
• LogD (pH = 7.4): -1.6848925
• Log P: -1.6848925

分子性质

理化性质

• 溶解度: DMSO; Methanol
• 外观: Off-White Solid
• 熔点: 150-152°C

安全信息

• 保存条件: Refrigerator

详细说明

Toronto Research Chemicals - P500802

Labelled Piracetam (P500800). Nootropic.

参考文献

• Gobert, J., et al.: J. Pharm. Belg., 27, 281 (1972)
• Oosterveld, W.J., et al.: Arzneim.-Forsch., 30, 1947 (1972)
• Chouinard, G., et al.: Psychopharmacol. Bull., 17, 129 (1972)