Cas no 918490-45-6 (6-(3-Piperidinyloxy)Isoquinoline)
918490-45-6 structure
Product Name:6-(3-Piperidinyloxy)Isoquinoline
CAS No:918490-45-6
MF:C14H16N2O
MW:228.289643287659
CID:2115166
Update Time:2023-08-04
6-(3-Piperidinyloxy)Isoquinoline Chemical and Physical Properties
Names and Identifiers
-
- 6-(3-piperidinyloxy)Isoquinoline
- BDBM50417845
- 6-(3-Piperidinyloxy)Isoquinoline
-
- Inchi： 1S/C14H16N2O/c1-2-14(10-15-6-1)17-13-4-3-12-9-16-7-5-11(12)8-13/h3-5,7-9,14-15H,1-2,6,10H2
- InChI Key： NVJUVAVYDGABBK-UHFFFAOYSA-N
- SMILES： O(C1C=CC2C=NC=CC=2C=1)C1CNCCC1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 246
- XLogP3: 2.3
- Topological Polar Surface Area: 34.2
6-(3-Piperidinyloxy)Isoquinoline Related Literature
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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