CAS 79421-46-8

1-(4-Cyanophenyl)-4-piperidinone

Description:

1-(4-Cyanophenyl)-4-piperidinone, with the CAS number 79421-46-8, is an organic compound characterized by its piperidinone structure, which includes a piperidine ring and a cyanophenyl group. This compound typically exhibits a white to off-white crystalline appearance and is soluble in organic solvents. Its molecular structure features a carbonyl group (C=O) adjacent to the piperidine nitrogen, contributing to its reactivity and potential applications in medicinal chemistry. The presence of the cyano group (-CN) on the phenyl ring enhances its electronic properties, making it a useful intermediate in the synthesis of various pharmaceuticals and agrochemicals. Additionally, the compound may exhibit biological activity, which can be explored for potential therapeutic uses. Safety data should be consulted for handling and storage, as with any chemical substance, to ensure proper precautions are taken. Overall, 1-(4-Cyanophenyl)-4-piperidinone is a significant compound in organic synthesis and drug development.

Formula: C₁₂H₁₂N₂O

InChI: InChI=1S/C12H12N2O/c13-9-10-1-3-11(4-2-10)14-7-5-12(15)6-8-14/h1-4H,5-8H2

InChI key: InChIKey=RJWQDPGTDSRETR-UHFFFAOYSA-N

SMILES: C(#N)C1=CC=C(C=C1)N2CCC(=O)CC2

Synonyms:

• 4-(4-Oxo-1-piperidinyl)benzonitrile
• 4-(4-Oxopiperidin-1-yl)benzonitrile
• 1-(4-Cyanophenyl)-4-piperidone
• Benzonitrile, 4-(4-oxo-1-piperidinyl)-
• 1-(4-Cyanophenyl)-4-piperidinone

4-(4-Oxopiperidin-1-yl)benzonitrile

CAS: 79421-46-8

Versatile small molecule scaffold

Formula: C₁₂H₁₂N₂O

Purity: Min. 95%

Molecular weight: 200.24 g/mol

Ref: 3D-EDA42146