Cas no 1030389-13-9 ((5-Bromo-pyrimidin-2-yl)-piperidin-3-ylamine)
1030389-13-9 structure
Product Name:(5-Bromo-pyrimidin-2-yl)-piperidin-3-ylamine
CAS No:1030389-13-9
MF:C9H13BrN4
MW:257.130320310593
CID:2149965
Update Time:2023-08-05
(5-Bromo-pyrimidin-2-yl)-piperidin-3-ylamine Chemical and Physical Properties
Names and Identifiers
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- (5-bromo-pyrimidin-2-yl)-piperidin-3-ylamine
- YUQFOMSSKWFDOT-UHFFFAOYSA-N
- 5-bromo-N-(piperidin-3-yl)pyrimidin-2-amine
- (5-Bromo-pyrimidin-2-yl)-piperidin-3-ylamine
-
- Inchi： 1S/C9H13BrN4/c10-7-4-12-9(13-5-7)14-8-2-1-3-11-6-8/h4-5,8,11H,1-3,6H2,(H,12,13,14)
- InChI Key： YUQFOMSSKWFDOT-UHFFFAOYSA-N
- SMILES： BrC1C=NC(=NC=1)NC1CNCCC1
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 170
- Topological Polar Surface Area: 49.8
(5-Bromo-pyrimidin-2-yl)-piperidin-3-ylamine Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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