4-二甲基氨基-2-萘-1-基丁腈 | 2809-54-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 中文名称: 4-二甲基氨基-2-萘-1-基丁腈
• 英文名称: 4-dimethylamino-2-[1]naphthyl-butyronitrile
• 英文别名: 4-Dimethylamino-2-[1]naphthyl-butyronitril；4-Dimethylamino-2-(naphth-1-yl)butyronitrile；α-<2-Dimethylamino-aethyl>-1-naphthylacetonitril；α-(2-Dimethylamino-aethyl)-naphthyl-(1)-acetonitril；alpha-(2-(Dimethylamino)ethyl)-1-naphthaleneacetonitrile；4-(dimethylamino)-2-naphthalen-1-ylbutanenitrile
• CAS: 2809-54-3
• 化学式: C₁₆H₁₈N₂
• 分子量: 238.332
• InChiKey: XWDJWSFNFKEVBR-UHFFFAOYSA-N

物化性质

• 沸点：
  171-173 °C(Press: 2 Torr)
• 密度：
  1.065±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  18
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  27
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  4-二甲基氨基-2-萘-1-基丁腈 在 氢氧化钾 作用下， 以 乙醇 为溶剂， 生成 alpha-[2-(二甲基氨基)乙基]-alpha-(3-甲基-2-丁烯基)-1-萘乙酰胺
  参考文献：
  名称：

  Analgetic-antiinflammatory activity of prenyl derivatives of basic naphthylalkylnitriles and naphthylalkylamides chemically related to naphthypramide

  摘要：

  DOI：

  10.1021/jm00264a038
• 作为产物：
  描述：

  1-萘乙腈 、 2-氯-N,N-二甲基乙胺 在 sodium amide 、 甲苯 作用下， 生成 4-二甲基氨基-2-萘-1-基丁腈
  参考文献：
  名称：

  Histamine Antagonists. γ,γ-Disubstituted N,N-Dialkylpropylamines¹

  摘要：

  DOI：

  10.1021/ja01156a078

文献信息

• Aromatic derivatives, their preparation and their use as antimicrobial
  申请人：Sanofi

  公开号：US04916156A1

  公开（公告）日：1990-04-10

  The present invention relates to aromatic derivatives of the formula: ##STR1## in which: n represents an integer between 2 and 10; R.sub.1 and R.sub.2 are identical or different and represent a cycloalkyl containing 3 to 6 carbon atoms or an alkyl containing from 1 to 6 carbon atoms which is unsubstituted or substituted by a phenyl or benzyl group; or R.sub.1 and R.sub.2, together with the nitrogen atom to which they are bonded, form a heterocycle selected from pyrrolidin-1-yl, piperidino, azepin-1-yl, hexamethyleneimino, 4-methylpiperidino, 4-benzylpiperidino, 4-phenylpiperidino, 1,2,3,4-tetrahydroisoquinol-2-yl, morpholino and imidazol-1-yl groups; R.sub.3 represents a hydrogen, a halogen, a methyl or a phenyl; R.sub.4 represents a hydrogen, a halogen or a methyl; or R.sub.3 and R.sub.4, taken together with the benzene ring to which they are bonded, form a naphth-1-yl or naphth-2-yl group; Y represents a direct bond, a methyleneoxy group, a methylenethio group or a vinylene group; and R.sub.5 represents an alkyl containing from 5 to 18 carbon atoms, a cycloalkyl containing from 3 to 8 carbon atoms, an adamantyl, naphth-1-yl or naphth-2-yl group, an unsubstituted phenyl group or a phenyl group substituted by one or 2 substituents selected from halogen atoms, the trifluoromethyl group, the nitro group and the phenyl group; and to their salts with mineral or organic acids.

  本发明涉及以下式的芳香族衍生物：##STR1## 其中：n表示2到10之间的整数；R.sub.1和R.sub.2相同或不同，表示含有3到6个碳原子的环烷基或含有1到6个碳原子的烷基，其未被取代或被苯基或苄基基团取代；或R.sub.1和R.sub.2与它们所连接的氮原子一起形成选自吡咯烷-1-基、哌啶基、氮杂辛基、六亚甲基、4-甲基哌啶基、4-苄基哌啶基、4-苯基哌啶基、1,2,3,4-四氢异喹啉-2-基、吗啉和咪唑-1-基团的杂环；R.sub.3表示氢、卤素、甲基或苯基；R.sub.4表示氢、卤素或甲基；或R.sub.3和R.sub.4与它们所连接的苯环一起形成萘-1-基或萘-2-基团；Y表示直接键、亚甲氧基团、亚甲硫基团或乙烯基团；R.sub.5表示含有5到18个碳原子的烷基、含有3到8个碳原子的环烷基、金刚烷基、萘-1-基或萘-2-基团、未被取代的苯基或被1或2个取代基取代的苯基，所述取代基选自卤素原子、三氟甲基基团、硝基和苯基；以及它们与矿物酸或有机酸的盐。
• Aromatic derivatives and their use as antimicrobial agents
  申请人：Sanofi

  公开号：US05089251A1

  公开（公告）日：1992-02-18

  The present invention relates to aromatic derivatives of the formula: ##STR1## in which: n represents an integer between 2 and 10; R.sub.1 and R.sub.2 are identical or different and represent a cycloalkyl containing 3 to 6 carbon atoms or an alkyl containing from 1 to 6 carbon atoms which is unsubstituted or substituted by a phenyl or benzyl group; or R.sub.1 and R.sub.2, together with the nitrogen atom to which they are bonded, form a heterocycle selected from pyrrolidin-1-yl, piperidino, azepin-1-yl, hexamethyleneimino, 4-methylpiperidino, 4-benzylpiperidino, 4-phenylpiperidino, 1,2,3,4-tetrahydroisoquinol-2-yl, morpholino and imidazol-1-yl groups; R.sub.3 represents a hydrogen, a halogen, a methyl or a phenyl; R.sub.4 represents a hydrogen, a halogen or a methyl; or R.sub.3 and R.sub.4, taken together with the benzene ring to which they are bonded, form a naphth-1-yl or naphth-2-yl group; Y represents a direct bond, a methyleneoxy group, a methylenethio group or a vinylene group; and R.sub.5 represents an alkyl containing from 5 to 18 carbon atoms, a cycloalkyl containing from 3 to 8 carbon atoms, an adamantyl, naphth-1-yl or naphth-2-yl group, an unsubstituted phenyl group or a phenyl group substituted by one or 2 substituents selected from halogen atoms, the trifluoromethyl group, the nitro group and the phenyl group; and to their salts with mineral or organic acids. Application: antimicrobial agents.

  本发明涉及公式为：##STR1## 的芳香族衍生物，其中：n表示2至10之间的整数；R.sub.1和R.sub.2相同或不同，表示含有3至6个碳原子的环烷基或含有1至6个碳原子的烷基，该烷基未被取代或被苯基或苄基取代；或R.sub.1和R.sub.2与它们所连接的氮原子一起形成选自吡咯烷-1-基、哌啶基、氮杂环己烷-1-基、六亚甲基、4-甲基哌啶基、4-苄基哌啶基、4-苯基哌啶基、1,2,3,4-四氢异喹啉-2-基、吗啉和咪唑-1-基的杂环；R.sub.3表示氢、卤素、甲基或苯基；R.sub.4表示氢、卤素或甲基；或R.sub.3和R.sub.4与它们所连接的苯环一起形成萘-1-基或萘-2-基；Y表示直接键、亚甲氧基、亚甲硫基或乙烯基；R.sub.5表示含有5至18个碳原子的烷基、含有3至8个碳原子的环烷基、金刚烷基、萘-1-基或萘-2-基、未取代的苯基或被卤素原子、三氟甲基基团、硝基基团和苯基中的1个或2个取代基取代的苯基；以及它们与矿物酸或有机酸的盐。应用：抗微生物剂。
• MOSSE, MADELEINE;PROIETTO, VINCENZO
  作者：MOSSE, MADELEINE、PROIETTO, VINCENZO

  DOI：——

  日期：——
• US4916156A
  申请人：——

  公开号：US4916156A

  公开（公告）日：1990-04-10
• US5089251A
  申请人：——

  公开号：US5089251A

  公开（公告）日：1992-02-18