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Home > Pyridines > 827323-00-2
827323-00-2 | 3-Pyridinecarbonitrile, 6-(3-phenyl-1-piperidinyl)-
CAS No: 827323-00-2 Catalog No: AG004ZVX MDL No:
Product Description
Catalog Number:
AG004ZVX
Chemical Name:
3-Pyridinecarbonitrile, 6-(3-phenyl-1-piperidinyl)-
CAS Number:
827323-00-2
Molecular Formula:
C17H17N3
Molecular Weight:
263.3370
IUPAC Name:
6-(3-phenylpiperidin-1-yl)pyridine-3-carbonitrile
InChI:
InChI=1S/C17H17N3/c18-11-14-8-9-17(19-12-14)20-10-4-7-16(13-20)15-5-2-1-3-6-15/h1-3,5-6,8-9,12,16H,4,7,10,13H2
InChI Key:
IZJGXKKCJOLITJ-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(nc1)N1CCCC(C1)c1ccccc1
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.142g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.344g/mol
Monoisotopic Mass:
263.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
39.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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