Cas no 1420904-00-2 (6-Bromo-N-methyl-N-(piperidin-3-ylmethyl)pyridin-2-amine;hydrochloride)
1420904-00-2 structure
Product Name:6-Bromo-N-methyl-N-(piperidin-3-ylmethyl)pyridin-2-amine;hydrochloride
CAS No:1420904-00-2
MF:C12H19BrClN3
MW:320.656360864639
CID:2170057
Update Time:2023-08-05
6-Bromo-N-methyl-N-(piperidin-3-ylmethyl)pyridin-2-amine;hydrochloride Chemical and Physical Properties
Names and Identifiers
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- 6-Bromo-n-methyl-n-(piperidin-3-ylmethyl)pyridin-2-amine hydrochloride
- 6-Bromo-N-methyl-N-(piperidin-3-ylmethyl)pyridin-2-amine;hydrochloride
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- Inchi： 1S/C12H18BrN3.ClH/c1-16(9-10-4-3-7-14-8-10)12-6-2-5-11(13)15-12;/h2,5-6,10,14H,3-4,7-9H2,1H3;1H
- InChI Key： FZKTYUYIGWIGGN-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC(=N1)N(C)CC1CNCCC1.Cl
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 212
- Topological Polar Surface Area: 28.2
6-Bromo-N-methyl-N-(piperidin-3-ylmethyl)pyridin-2-amine;hydrochloride Related Literature
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Vitaly Gurylev,Chung-Yi Su,Tsong-Pyng Perng Phys. Chem. Chem. Phys., 2016,18, 16033-16038
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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