4-Piperidinecarbonitrile, 4-(methylamino)-1-(phenylmethyl)-


Chemical Name: 4-Piperidinecarbonitrile, 4-(methylamino)-1-(phenylmethyl)-
CAS Number: 953-79-7
Product Number: AG003DZS(AGN-PC-0JL9NJ)
Synonyms:
MDL No:
Molecular Formula: C14H19N3
Molecular Weight: 229.3208

Identification/Properties


Computed Properties
Molecular Weight:
229.327g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
229.158g/mol
Monoisotopic Mass:
229.158g/mol
Topological Polar Surface Area:
39.1A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
277
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



4-(Methylamino)-1-(phenylmethyl)-4-piperidinecarbonitrile is a versatile compound widely utilized in chemical synthesis processes. This molecule serves as a key building block in the creation of various pharmaceuticals, agrochemicals, and advanced materials due to its unique structural properties and reactivity. In organic synthesis, it acts as a valuable intermediate for the construction of complex organic molecules through the formation of new carbon-carbon and carbon-nitrogen bonds. Its presence in the molecular structure imparts specific functionalities that are essential for the desired chemical transformations, making it an indispensable component in the synthesis of diverse chemical compounds. Additionally, the incorporation of 4-(Methylamino)-1-(phenylmethyl)-4-piperidinecarbonitrile enables the fine-tuning of molecular properties such as solubility, stability, and biological activity, making it a crucial tool for the development of novel compounds with tailored characteristics.