N-(13-methyltetradecyl)acetamide

• ChemBase编号: 163604
• 分子式: C17H35NO
• 平均质量: 269.4659
• 单一同位素质量: 269.27186475
• SMILES: C(CCCCCCCCCCCCNC(=O)C)(C)C
• Canonical SMILES: CC(CCCCCCCCCCCCNC(=O)C)C
• InChI: InChI=1S/C17H35NO/c1-16(2)14-12-10-8-6-4-5-7-9-11-13-15-18-17(3)19/h16H,4-15H2,1-3H3,(H,18,19)
• InChIKey: AMLDBWWQKYLAHJ-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: N-(13-methyltetradecyl)acetamide
• IUPAC传统名: N-(13-methyltetradecyl)acetamide
• 别名: N-(13-Methyltetradecyl)acetamide; Cap-A; Capsi-amide; Capsiamide

登记号

• CAS号: 64317-66-4
• PubChem SID: 162257739
• PubChem CID: 47346

理论计算性质

• Acid pKa: 16.447847
• 质子受体: 1
• 质子供体: 1
• LogD (pH = 5.5): 5.2499924
• LogD (pH = 7.4): 5.2499924
• Log P: 5.2499924
• 摩尔折射率: 83.7948 cm^3
• 极化性: 33.27293 Å^3
• 极化表面积: 29.1 Å^2
• 可自由旋转的化学键: 13
• 里宾斯基五规则: false

详细说明

Toronto Research Chemicals - C175715

Capsiamide is a long chain amide found in essential oil of Capsicum (all hot pepper varieties). Studies showed that Capsiamide decreased spontaneous motor activity and produced a significant prolongation of sleeping time after sodium pentobarbital.

参考文献

• Takahashi, M. et al.: Koen Yohishu, 23, 1 (1979)
• Takahashi, M. et al.: Oyo Yakuri, 19, 231 (1979)