2,5-二甲基吡唑并[1,5-A]嘧啶-7-胺 | 2369-89-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡唑并嘧啶类
• 中文名称: 2,5-二甲基吡唑并[1,5-A]嘧啶-7-胺
• 英文名称: 7-amino-2,5-dimethylpyrazolo[1,5-a]pyrimidine
• 英文别名: 2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-ylamine；2,5-Dimethyl-pyrazolo[1,5-a]pyrimidin-7-ylamin；2,5-dimethyl-7-aminopyrazolo[2,3-a]pyrimidine radical；2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-amine；2.5-Dimethyl-7-amino-pyrazolo-<1.5-a>pyrimidin；2,5-Dimethyl-7-amino-pyrazolo<1,5-a>pyrimidin
• CAS: 2369-89-3
• 化学式: C₈H₁₀N₄
• mdl: MFCD00995337
• 分子量: 162.194
• InChiKey: PTDZZLRAEVFJCM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.8
• 重原子数：
  12
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  56.2
• 氢给体数：
  1
• 氢受体数：
  3

安全信息

• 危险等级：
  IRRITANT
• 海关编码：
  2933990090

反应信息

• 作为反应物：
  描述：

  2,5-二甲基吡唑并[1,5-A]嘧啶-7-胺 在 palladium on activated charcoal 硫酸 、 一水合肼 、 sodium nitrite 作用下， 以 甲醇 、 乙醇 、 水 为溶剂， 反应 3.0h， 生成 2,5-dimethylpyrazolo[1,5-a]pyrimidine-3,7-diamine
  参考文献：
  名称：

  A hydrogen-bonded chain of rings in 7-amino-5-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine, and a hydrogen-bonded framework structure in 3,7-diamino-2,5-dimethylpyrazolo[1,5-a]pyrimidine monohydrate

  摘要：

  In 7-amino-5-tert-butyl-2-methylpyrazolo[1,5-a] pyrimidine, C11H16N4, which crystallizes with Z' = 2 in the space group P (1) over bar, the independent molecules are linked by four N-H center dot center dot center dot N hydrogen bonds into chains containing three types of ring. In 3,7-diamino-2,5-dimethylpyrazolo[1,5-a] pyrimidine monohydrate, C8H11N5 center dot H2O, the molecular components are linked into a three-dimensional framework structure by a combination of O-H center dot center dot center dot N, N-H center dot center dot center dot N and N-H center dot center dot center dot O hydrogen bonds.

  DOI：

  10.1107/s0108270106025893
• 作为产物：
  描述：

  2-aminocrotononitrile 、 S-(4-叔-丁基苯甲基)[2-(1-甲基丁基)吡啶-3-基]硫代氨基甲酸酯 在 sodium acetate 作用下， 以 乙醇 、 水 为溶剂， 以38%的产率得到2,5-二甲基吡唑并[1,5-A]嘧啶-7-胺
  参考文献：
  名称：

  Synthesis of novel 5-amino-1-aroylpyrazoles

  摘要：

  A series of 5-amino-1-aroylpyrazoles 3 are synthesized directly by the reaction of beta-aminocrotononitrile 1 with some structures containing the hydrazine moiety (X-NHNH2) 2 by refluxing ethanol in presence of sodium acetate. When semicarbazide 3i was used (X = CONH2), the reaction afforded the unexpected 7-aminopyrazolo[1,5-a]pyrimidine 4. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2008.07.166

文献信息

• Pyrazolo[1,5-a]pyrido[3,2-e]pyrimidine-7-carboxylic acid derivatives
  申请人：E. R. Squibb & Sons, Inc.

  公开号：US04066643A1

  公开（公告）日：1978-01-03

  New derivatives of pyrazolo[1,5-a]pyrido[3,2-e]-pyrimidine-7-carboxylic acid have the general formula ##STR1## The new compounds are useful as central nervous system depressants and an anti-inflammatory agents.

  新的吡唑并[1,5-a]吡啶并[3,2-e]-嘧啶-7-羧酸衍生物具有一般公式##STR1## 这些新化合物可用作中枢神经系统抑制剂和抗炎药物。
• Electrooxidative C-H Functionalization of Heteroarenes. Thiocyanation of Pyrazolo[1,5-<i>a</i> ]pyrimidines
  作者：Vladimir A. Kokorekin、Rauza R. Yaubasarova、Sergei V. Neverov、Vladimir A. Petrosyan

  DOI：10.1002/ejoc.201900390

  日期：2019.7.14

  An effective system of approaches to electrooxidative C–H thiocyanation of both high and low reactive pyrazolo[1,5‐a]pyrimidines under mild conditions has been proposed for the first time. The process scaling up, the antifungal activity of resulting thiocyanates, and possibility of their transformation into thiols also demonstrate advantages and viability of this direct C–S coupling strategy. In general

  首次提出了在温和条件下有效反应高和低反应性吡唑并[1,5- a ]嘧啶的C–H硫氰化方法的有效体系。规模扩大的过程，所得硫氰酸盐的抗真菌活性以及将其转化为硫醇的可能性也证明了这种直接C-S偶联策略的优势和可行性。通常，温和的反应条件和高的C–S键形成效率使这种基于吡唑并[1,5- a ]嘧啶的电氧化C–H硫氰化的策略在未来的应用中非常可行。
• Etchant, replenishment solution and method for forming copper wiring
  申请人：MEC COMPANY LTD.

  公开号：US10174428B2

  公开（公告）日：2019-01-08

  An etchant for copper includes an acid and one or more compounds selected from the group consisting of an aliphatic noncyclic compound, an aliphatic heterocyclic compound and a heteroaromatic compound. The aliphatic noncyclic compound is a saturated aliphatic noncyclic compound (A) including only two or more nitrogen atoms as heteroatoms, and 2 to 10 carbon atoms. The aliphatic heterocyclic compound is a compound (B) including a five-, six-, or seven-membered ring having one or more nitrogen atoms as one or more heteroatoms constituting the ring. The heteroaromatic compound is a compound (C) including a six-membered heteroaromatic ring having one or more nitrogen atoms as one or more heteroatoms constituting the ring.

  铜的蚀刻剂包括酸和一种或多种选自脂肪族非环化合物、脂肪族杂环化合物和杂芳香族化合物的化合物。脂肪族非环化合物是饱和脂肪族非环化合物 (A)，只包括两个或两个以上的氮原子作为杂原子，以及 2 至 10 个碳原子。脂族杂环化合物是一种化合物（B），包括一个五元环、六元环或七元环，其中有一个或多个氮原子作为构成环的一个或多个杂原子。杂芳香族化合物是一种化合物（C），包括一个六元杂芳香环，该环具有一个或多个氮原子作为构成环的一个或多个杂原子。
• 7-Amino-2,5-dimethylpyrazolo[1,5-<i>a</i>]pyrimidine hemihydrate redetermined at 120 K: a three-dimensional hydrogen-bonded framework
  作者：Jaime Portilla、Jairo Quiroga、Justo Cobo、John N. Low、Christopher Glidewell

  DOI：10.1107/s0108270106005373

  日期：2006.3.11

  In the title compound, C8H10N4 center dot 0.5H(2)O, where the water molecules lie on twofold rotation axes in the space group C2, the components are linked by three hydrogen bonds, one each of O - H center dot center dot center dot N, N - H center dot center dot center dot N and N - H center dot center dot center dot O types, into a complex three-dimensional framework structure.
• Monoazofarbstoffe, deren Herstellung und Verwendung
  申请人：CIBA-GEIGY AG

  公开号：EP0101408B1

  公开（公告）日：1986-05-07