Home Nitriles 3-(pyridin-2-yl)piperidine-3-carbonitrile

3-(pyridin-2-yl)piperidine-3-carbonitrile

CAS No.:
1909318-92-8
Catalog Number:
AG01C4O1
Molecular Formula:
C11H13N3
Molecular Weight:
187.2410
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Product Description
Catalog Number:
AG01C4O1
Chemical Name:
3-(pyridin-2-yl)piperidine-3-carbonitrile
CAS Number:
1909318-92-8
Molecular Formula:
C11H13N3
Molecular Weight:
187.2410
MDL Number:
MFCD29906942
IUPAC Name:
3-pyridin-2-ylpiperidine-3-carbonitrile
InChI:
InChI=1S/C11H13N3/c12-8-11(5-3-6-13-9-11)10-4-1-2-7-14-10/h1-2,4,7,13H,3,5-6,9H2
InChI Key:
JIYSNAASQINWNJ-UHFFFAOYSA-N
SMILES:
N#CC1(CCCNC1)c1ccccn1
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.111g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.246g/mol
Monoisotopic Mass:
187.111g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
48.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties