Cas no 62396-49-0 ((3R)-1-benzyl-N-ethyl-N-methylpyrrolidin-3-amine)
62396-49-0 structure
Product Name:(3R)-1-benzyl-N-ethyl-N-methylpyrrolidin-3-amine
CAS No:62396-49-0
MF:C14H22N2
MW:218.337883472443
CID:1638567
PubChem ID:3046568
Update Time:2025-04-21
(3R)-1-benzyl-N-ethyl-N-methylpyrrolidin-3-amine Chemical and Physical Properties
Names and Identifiers
-
- (3R)-1-benzyl-N-ethyl-N-methylpyrrolidin-3-amine
- D-(R)-N-Benzyl-3-ethylmethylaminopyrrolidine dihydrochloride
- 62396-49-0
- Pyrrolidine, 1-benzyl-3-(ethylmethylamino)-, D-(R)-
- Pyrrolidine, 1-benzyl-3-(ethylmethylamino)-, dihydrochloride, D-(R)-
- DTXSID30211445
- 3-Pyrrolidineamine, 1-benzyl-N-ethyl-N-methyl-, dihydrochloride, (R)-
-
- Inchi： 1S/C14H22N2/c1-3-15(2)14-9-10-16(12-14)11-13-7-5-4-6-8-13/h4-8,14H,3,9-12H2,1-2H3/t14-/m1/s1
- InChI Key： YFJFURKFAKMJMP-CQSZACIVSA-N
- SMILES： N1(CC2C=CC=CC=2)CC[C@H](C1)N(C)CC
Computed Properties
- Exact Mass: 218.17846
- Monoisotopic Mass: 218.178298710g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 199
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.4
- Topological Polar Surface Area: 6.5?2
Experimental Properties
- PSA: 6.48
(3R)-1-benzyl-N-ethyl-N-methylpyrrolidin-3-amine Related Literature
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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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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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