Home Nitriles 6-[4-(4-fluorophenyl)piperazin-1-yl]pyridine-3-carbonitrile

6-[4-(4-fluorophenyl)piperazin-1-yl]pyridine-3-carbonitrile

CAS No.:
1016891-05-6
Catalog Number:
AG019TUF
Molecular Formula:
C16H15FN4
Molecular Weight:
282.3155
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Product Description
Catalog Number:
AG019TUF
Chemical Name:
6-[4-(4-fluorophenyl)piperazin-1-yl]pyridine-3-carbonitrile
CAS Number:
1016891-05-6
Molecular Formula:
C16H15FN4
Molecular Weight:
282.3155
MDL Number:
MFCD09936073
IUPAC Name:
6-[4-(4-fluorophenyl)piperazin-1-yl]pyridine-3-carbonitrile
InChI:
InChI=1S/C16H15FN4/c17-14-2-4-15(5-3-14)20-7-9-21(10-8-20)16-6-1-13(11-18)12-19-16/h1-6,12H,7-10H2
InChI Key:
CJXYKZNNQVWEDC-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(nc1)N1CCN(CC1)c1ccc(cc1)F
Properties
Complexity:
377  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.128g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.322g/mol
Monoisotopic Mass:
282.128g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties