Home Nitriles 2-amino-4-phenyl-6-(pyrrolidin-1-yl)pyridine-3,5-dicarbonitrile

2-amino-4-phenyl-6-(pyrrolidin-1-yl)pyridine-3,5-dicarbonitrile

CAS No.:
77034-27-6
Catalog Number:
AG01EJT3
Molecular Formula:
C17H15N5
Molecular Weight:
289.3345
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Product Description
Catalog Number:
AG01EJT3
Chemical Name:
2-amino-4-phenyl-6-(pyrrolidin-1-yl)pyridine-3,5-dicarbonitrile
CAS Number:
77034-27-6
Molecular Formula:
C17H15N5
Molecular Weight:
289.3345
MDL Number:
MFCD00763864
IUPAC Name:
2-amino-4-phenyl-6-pyrrolidin-1-ylpyridine-3,5-dicarbonitrile
InChI:
InChI=1S/C17H15N5/c18-10-13-15(12-6-2-1-3-7-12)14(11-19)17(21-16(13)20)22-8-4-5-9-22/h1-3,6-7H,4-5,8-9H2,(H2,20,21)
InChI Key:
DQDILNDNGZRYFK-UHFFFAOYSA-N
SMILES:
N#Cc1c(nc(c(c1c1ccccc1)C#N)N)N1CCCC1
Properties
Complexity:
474  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.133g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
289.342g/mol
Monoisotopic Mass:
289.133g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
89.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Literature
Title Journal
Multipotent drugs with cholinergic and neuroprotective properties for the treatment of Alzheimer and neuronal vascular diseases. I. Synthesis, biological assessment, and molecular modeling of simple and readily available 2-aminopyridine-, and 2-chloropyridine-3,5-dicarbonitriles. Bioorganic & medicinal chemistry 20100815
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties