HCID22999713

3-(2-methoxyethoxy)-1-methyl-4-(4-methylphenyl)-1H-pyrazol-5-ylamine

3-(2-methoxyethoxy)-1-methyl-4-(4-methylphenyl)pyrazol-5-amine

C14H19N3O2261.32 g/mol

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IDENTITY

结构与身份

标准SMILES: COCCOc1nn(C)c(N)c1-c1ccc(C)cc1
InChIKey: HGMLAZXWJYVTHI-UHFFFAOYSA-N
分子式: C14H19N3O2
平均分子量: 261.32 g/mol
单同位素质量: 261.14772686

COMPUTED

结构计算性质

已同步

XLogP: 2
极性表面积: 62.3 Å²
氢键供体: 1
氢键受体: 4
可旋转键: 5
重原子: 19
形式电荷: 0
复杂度: 269

ALIASES

名称与别名

共 4 条

SCHEMBL6288971HGMLAZXWJYVTHI-UHFFFAOYSA-N3-(2-methoxyethoxy)-1-methyl-4-(4-methylphenyl)-1H-pyrazol-5-ylamine5-amino-3-(2-methoxyethoxy)-1-methyl-4-(4-methylphenyl)-1H-pyrazole

REACTIONS

参与反应

4 条

uspto-grants-2003_08 · 10.6084/m9.figshare.5104873.v1 · US06610518B2

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Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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uspto-grants-2005_11 · 10.6084/m9.figshare.5104873.v1 · US06962923B2

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uspto-grants-2003_06 · 10.6084/m9.figshare.5104873.v1 · US06573270B1

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