Home Carboxys tert-butyl 3-[(2-cyanopyridin-4-yl)oxy]pyrrolidine-1-carboxylate

tert-butyl 3-[(2-cyanopyridin-4-yl)oxy]pyrrolidine-1-carboxylate

CAS No.:
1803591-76-5
Catalog Number:
AG01BCWB
Molecular Formula:
C15H19N3O3
Molecular Weight:
289.3297
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Product Description
Catalog Number:
AG01BCWB
Chemical Name:
tert-butyl 3-[(2-cyanopyridin-4-yl)oxy]pyrrolidine-1-carboxylate
CAS Number:
1803591-76-5
Molecular Formula:
C15H19N3O3
Molecular Weight:
289.3297
MDL Number:
MFCD28012329
IUPAC Name:
tert-butyl 3-(2-cyanopyridin-4-yl)oxypyrrolidine-1-carboxylate
InChI:
InChI=1S/C15H19N3O3/c1-15(2,3)21-14(19)18-7-5-13(10-18)20-12-4-6-17-11(8-12)9-16/h4,6,8,13H,5,7,10H2,1-3H3
InChI Key:
QILKYBHHUCMWQW-UHFFFAOYSA-N
SMILES:
N#Cc1nccc(c1)OC1CCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
424  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.143g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.335g/mol
Monoisotopic Mass:
289.143g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties