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2-amino-N,N-dimethyl-5-methoxy-benzylamine | 55412-51-6

中文名称
——
中文别名
——
英文名称
2-amino-N,N-dimethyl-5-methoxy-benzylamine
英文别名
2-[(dimethylamino)methyl]-4-methoxyaniline
2-amino-N,N-dimethyl-5-methoxy-benzylamine化学式
CAS
55412-51-6
化学式
C10H16N2O
mdl
——
分子量
180.25
InChiKey
KWOOYVLMIMRTBO-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    0.7
  • 重原子数:
    13
  • 可旋转键数:
    3
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.4
  • 拓扑面积:
    38.5
  • 氢给体数:
    1
  • 氢受体数:
    3

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量
  • 下游产品
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为反应物:
    参考文献:
    名称:
    Aminobenzyl-amides and salts thereof
    摘要:
    公式为##SPC1##的化合物,其中R.sub.1是氢或脂肪或芳香族羧酰基,R.sub.2是氢、氯或溴,R.sub.3是1至4个碳原子的氟、烷基、三氟甲基、氰基、氨基甲酰基、羧基、氨基羧酸酯、烷氧基、乙酰基、1-羟基乙基或##EQU1##其中R.sub.6和R.sub.7分别是烷基、环烷基、羟基环烷基或与彼此及它们附着的氮原子一起的吡咯烷基、哌啶基或吗啉基,R.sub.4和R.sub.5分别是氢、1至5个碳原子的烷基、1至5个碳原子的单或双羟基烷基、2至4个碳原子的烯基、5至7个碳原子的环烷基、5至7个碳原子的单或双羟基环烷基、苄基、吗啉甲酰甲基或与彼此及它们附着的氮原子一起的吡咯烷基、哌啶基、己亚甲基亚胺基、吗啉、N-甲基哌嗪或香叶基亚胺基,以及其无毒、药理学上可接受的酸盐;这些化合物及其盐可用作抗溃疡、分泌溶解剂、止咳剂以及刺激肺泡表面活性物质或抗肺不张因子的产生的刺激剂。
    公开号:
    US03950393A1
  • 作为产物:
    参考文献:
    名称:
    CH609327
    摘要:
    公开号:
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文献信息

  • [EN] BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS<br/>[FR] COMPOSÉS BICYCLIQUES SUBSTITUÉS PAR HÉTÉROARYLE
    申请人:BRISTOL MYERS SQUIBB CO
    公开号:WO2018013774A1
    公开(公告)日:2018-01-18
    Disclosed are compounds of Formula (I) to (VIII): (I) (II) (III) (IV) (V) (VI) (VII) (VIII); or a stereoisomer, tautomer, pharmaceutically acceptable salt, solvate or prodrug thereof, wherein R3 is a bicyclic heteroaryl group substituted with zero to 3 R3a; and R1, R2, R3a, R4, and n are defined herein. Also disclosed are methods of using such compounds as PAR4 inhibitors, and pharmaceutical compositions comprising such compounds. These compounds are useful in inhibiting or preventing platelet aggregation, and are useful for the treatment of a thromboembolic disorder or the primary prophylaxis of a thromboembolic disorder.
    公开了公式(I)至(VIII)的化合物:(I) (II) (III) (IV) (V) (VI) (VII) (VIII);或其立体异构体、互变异构体、药物可接受的盐、溶剂化物或前药,其中R3是与0至3个R3a取代的双环杂芳基团;且R1、R2、R3a、R4和n在此定义。还公开了使用这些化合物作为PAR4抑制剂的方法,以及包含这些化合物的药物组合物。这些化合物用于抑制或预防血小板聚集,用于治疗血栓栓塞障碍或作为血栓栓塞障碍的初级预防。
  • Aminobenzyl-amides and salts thereof
    申请人:Boehringer Ingelheim GmbH
    公开号:US03950393A1
    公开(公告)日:1976-04-13
    Compounds of the formula ##SPC1## Wherein R.sub.1 is hydrogen or aliphatic or aromatic carboxylic acyl, R.sub.2 is hydrogen, chlorine or bromine, R.sub.3 is fluorine, alkyl of 1 to 4 carbon atoms, trifluoromethyl, cyano, carbamoyl, carboxyl, carbalkoxy, alkoxy, acetyl, 1-hydroxyethyl or ##EQU1## where R.sub.6 and R.sub.7 are each alkyl, cycloalkyl, hydroxy-cycloalkyl or, together with each other and the nitrogen atom to which they are attached, pyrrolidino, piperidino or morpholino, and R.sub.4 and R.sub.5 are each hydrogen, alkyl of 1 to 5 carbon atoms, mono- or di-hydroxy (alkyl of 1 to 5 carbon atoms), alkenyl of 2 to 4 carbon atoms, cycloalkyl of 5 to 7 carbon atoms, mono- or di-hydroxy(cycloalkyl of 5 to 7 carbon atoms), benzyl, morpholinocarbonylmethyl or, together with each other and the nitrogen atom to which they are attached, pyrrolidino, piperidino, hexamethyleneimino, morpholino, N-methyl-piperazino or camphidino, And non-toxic, pharmacologically acceptable acid addition salts thereof; the compounds as well as their salts are useful as anti-ulcergenics, secretolytics, antitussive, and stimulants of the production of the surfactant or antiatelectasis factor of the alveoli.
    公式为##SPC1##的化合物,其中R.sub.1是氢或脂肪或芳香族羧酰基,R.sub.2是氢、氯或溴,R.sub.3是1至4个碳原子的氟、烷基、三氟甲基、氰基、氨基甲酰基、羧基、氨基羧酸酯、烷氧基、乙酰基、1-羟基乙基或##EQU1##其中R.sub.6和R.sub.7分别是烷基、环烷基、羟基环烷基或与彼此及它们附着的氮原子一起的吡咯烷基、哌啶基或吗啉基,R.sub.4和R.sub.5分别是氢、1至5个碳原子的烷基、1至5个碳原子的单或双羟基烷基、2至4个碳原子的烯基、5至7个碳原子的环烷基、5至7个碳原子的单或双羟基环烷基、苄基、吗啉甲酰甲基或与彼此及它们附着的氮原子一起的吡咯烷基、哌啶基、己亚甲基亚胺基、吗啉、N-甲基哌嗪或香叶基亚胺基,以及其无毒、药理学上可接受的酸盐;这些化合物及其盐可用作抗溃疡、分泌溶解剂、止咳剂以及刺激肺泡表面活性物质或抗肺不张因子的产生的刺激剂。
  • Aminobenzyl-amines and salts thereof
    申请人:Boehringer Ingelheim GmbH
    公开号:US04101671A1
    公开(公告)日:1978-07-18
    Compounds of the formula ##STR1## wherein R.sub.1 is hydrogen or aliphatic or aromatic carboxylic acyl, R.sub.2 is hydrogen, chlorine or bromine, R.sub.3 is fluorine, alkyl of 1 to 4 carbon atoms, trifluoromethyl, cyano, carbamoyl, carboxyl, carbalkoxy, alkoxy, acetyl, 1-hydroxyethyl or ##STR2## where R.sub.6 and R.sub.7 are each alkyl, cycloalkyl, hydroxy-cycloalkyl or, together with each other and the nitrogen atom to which they are attached, pyrrolidino, piperidino or morpholino, and R.sub.4 and R.sub.5 are each hydrogen, alkyl of 1 to 5 carbon atoms, mono- or di-hydroxy (alkyl of 1 to 5 carbon atoms), alkenyl of 2 to 4 carbon atoms, cycloalkyl of 5 to 7 carbon atoms, mono- or di-hydroxy (cycloalkyl of 5 to 7 carbon atoms), benzyl, morpholinocarbonylmethyl or, together with each other and the nitrogen atom to which they are attached, pyrrolidino, piperidino, hexamethyleneimino, morpholino, N-methyl-piperazino or camphidino, Provided, however, that when R.sub.3 is carboxyl or carbalkoxy, R.sub.4 and R.sub.5 are other than hydrogen, alkyl, mono- or di-hydroxyalkyl, alkenyl, cycloalkyl, mono- or di-hydroxy-cycloalkyl or benzyl; and non-toxic, pharmacologically acceptable acid addition salts thereof. The compounds as well as their salts are useful as anti-ulcerogenics.
    化合物的公式为##STR1##其中R.sub.1是氢或脂肪族或芳香族羧酰基,R.sub.2是氢,氯或溴,R.sub.3是氟,1至4个碳原子的烷基,三氟甲基,氰基,氨基甲酰基,羧基,羧烷氧基,烷氧基,乙酰基,1-羟乙基或##STR2##其中R.sub.6和R.sub.7分别是烷基,环烷基,羟基环烷基或与彼此和它们连接的氮原子一起的吡咯啉基,哌啶基或吗啉基,R.sub.4和R.sub.5分别是氢,1至5个碳原子的烷基,1至5个碳原子的单或双羟基(烷基),2至4个碳原子的烯基,5至7个碳原子的环烷基,5至7个碳原子的单或双羟基(环烷基),苄基,吗啉甲酰甲基或与彼此和它们连接的氮原子一起的吡咯啉基,哌啶基,己亚甲基亚胺,吗啉,N-甲基哌嗪或松香亚胺,但是当R.sub.3是羧基或羧烷氧基时,R.sub.4和R.sub.5除了烷基,单或双羟基烷基,烯基,环烷基,单或双羟基环烷基或苄基外,不能是氢;及其非毒性、药理学上可接受的酸盐。这些化合物及其盐可用作抗溃疡剂。
  • Dianthus plant named ‘KLEDP16231’
    申请人:Klemm+Sohn GmbH & Co. KG
    公开号:USPP029628P2
    公开(公告)日:2018-08-28
    A new Dianthus plant particularly distinguished by red flowers, good branching, and an upright habit, is disclosed.
    本发明公开了一种新的石竹植物,其特点是红色花朵、良好的分枝和直立的习性。
  • BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS
    申请人:Bristol-Myers Squibb Company
    公开号:EP3484878B1
    公开(公告)日:2020-08-19
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