Home Nitriles 2-(4-aminopiperidin-1-yl)benzonitrile hydrochloride

2-(4-aminopiperidin-1-yl)benzonitrile hydrochloride

CAS No.:
2060037-57-0
Catalog Number:
AG01BR6K
Molecular Formula:
C12H16ClN3
Molecular Weight:
237.7285
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Product Description
Catalog Number:
AG01BR6K
Chemical Name:
2-(4-aminopiperidin-1-yl)benzonitrile hydrochloride
CAS Number:
2060037-57-0
Molecular Formula:
C12H16ClN3
Molecular Weight:
237.7285
MDL Number:
MFCD16619441
IUPAC Name:
2-(4-aminopiperidin-1-yl)benzonitrile;hydrochloride
InChI:
InChI=1S/C12H15N3.ClH/c13-9-10-3-1-2-4-12(10)15-7-5-11(14)6-8-15;/h1-4,11H,5-8,14H2;1H
InChI Key:
OCGFPFFLHQBYOX-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1N1CCC(CC1)N.Cl
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.103g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
237.731g/mol
Monoisotopic Mass:
237.103g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties