HCID2737116

1-(3-Pentyl)piperazine

1-pentan-3-ylpiperazine

C9H20N2156.27 g/molCAS 373356-51-5

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IDENTITY

结构与身份

标准SMILES: CCC(CC)N1CCNCC1
InChIKey: IVPIAQOAOCEOKM-UHFFFAOYSA-N
分子式: C9H20N2
平均分子量: 156.27 g/mol
单同位素质量: 156.16264865

COMPUTED

结构计算性质

等待补全

XLogP: 1.5
极性表面积: 15.3 Å²
氢键供体: 1
氢键受体: 2
可旋转键: 3
重原子: 11
形式电荷: 0
复杂度: 93

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 25 条

373356-51-51-(3-Pentyl)piperazineDTXSID00371848RefChem:224588DTXCID103228811-(3-Pentyl)-piperazine1-(pentan-3-yl)piperazine1-(1-ETHYLPROPYL)PIPERAZINE1-pentan-3-ylpiperazineMFCD02093554piperazine, 1-(1-ethylpropyl)-, dihydrochloride1-(Pent-3-yl)piperazineSCHEMBL5101341-(1-ethylpropyl)-piperazineSCHEMBL4534735SCHEMBL4733476IVPIAQOAOCEOKM-UHFFFAOYSA-NALBB-020859YPA35651AKOS000264914

REACTIONS

相关反应

24 条

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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uspto-grants-2016_05 · 10.6084/m9.figshare.5104873.v1 · US09345713B2

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uspto-grants-2015_05 · 10.6084/m9.figshare.5104873.v1 · US09040522B2

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Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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Validation data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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uspto-grants-2007_10 · 10.6084/m9.figshare.5104873.v1 · US07279470B2

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