Cas no 1421049-85-5 (N-Methyl-3-nitro-N-[(3R)-piperidin-3-yl]pyridin-2-amine;hydrochloride)
1421049-85-5 structure
Product Name:N-Methyl-3-nitro-N-[(3R)-piperidin-3-yl]pyridin-2-amine;hydrochloride
CAS No:1421049-85-5
MF:C11H17ClN4O2
MW:272.731281042099
CID:2165323
Update Time:2023-08-05
N-Methyl-3-nitro-N-[(3R)-piperidin-3-yl]pyridin-2-amine;hydrochloride Chemical and Physical Properties
Names and Identifiers
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- (R)-n-methyl-3-nitro-n-(piperidin-3-yl)pyridin-2-amine hydrochloride
- N-Methyl-3-nitro-N-[(3R)-piperidin-3-yl]pyridin-2-amine;hydrochloride
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- Inchi: 1S/C11H16N4O2.ClH/c1-14(9-4-2-6-12-8-9)11-10(15(16)17)5-3-7-13-11;/h3,5,7,9,12H,2,4,6,8H2,1H3;1H/t9-;/m1./s1
- InChI Key: BBWHGMRGLIZEDS-SBSPUUFOSA-N
- SMILES: Cl.[O-][N+](C1=CC=CN=C1N(C)[C@H]1CNCCC1)=O
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 269
- Topological Polar Surface Area: 74
N-Methyl-3-nitro-N-[(3R)-piperidin-3-yl]pyridin-2-amine;hydrochloride Related Literature
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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