4-methoxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile

• ChemBase编号: 177533
• 分子式: C8H8N2O2
• 平均质量: 164.16132
• 单一同位素质量: 164.05857751
• SMILES: c1cc(c(c(=O)n1C)C#N)OC
• Canonical SMILES: N#Cc1c(OC)ccn(c1=O)C
• InChI: InChI=1S/C8H8N2O2/c1-10-4-3-7(12-2)6(5-9)8(10)11/h3-4H,1-2H3
• InChIKey: PETSAYFQSGAEQY-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 4-methoxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
• IUPAC传统名: ricinine; 4-methoxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
• 别名: 1,2-Dihydro-4-methoxy-1-methyl-2-oxo-3-pyridinecarbonitrile; 1,2-Dihydro-4-methoxy-1-methyl-2-oxonicotinonitrile; Recinine; NSC 409913; NSC 642604; Ricinin; Ricinine; 1,2-Dihydro-4-methoxy-1-methyl-2-oxo-3-pyridinecarbonitrile; 4-Methoxy-2-oxo-1-methyl-1,2-dihydronicotinonitrile; 3-Cyano-4-methoxy-1-methyl-2-pyridone; Ricinine

登记号

• CAS号: 524-40-3
• PubChem SID: 164233443
• PubChem CID: 10666

理论计算性质

• 质子受体: 3
• 质子供体: 0
• LogD (pH = 5.5): -0.2337896
• LogD (pH = 7.4): -0.2337896
• Log P: -0.2337896
• 摩尔折射率: 44.6391 cm^3
• 极化性: 16.039297 Å^3
• 极化表面积: 53.33 Å^2
• 可自由旋转的化学键: 1
• 里宾斯基五规则: true

分子性质

药理学性质

• 生物活性机理: Blocker of the GABA(A) receptor

产品相关信息

• 生物来源: Alkaloid from Ricinus communis (castor-oil) seed (Euphorbiaceae)
• 应用领域: Nootropic

详细说明

Toronto Research Chemicals - R495550

Ricinine is an alkaloid extract from the seeds of the castor-oil plant (Ricinus communalis). Ricinine is a central nervous system stimulant that could potentially be a cognition-enhancing agent used for the treatment of human amnesias. Ricinine also has b

参考文献

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