116574-75-5 Usage
Description
3-FLUOROPIPERIDINE, also known as 3-Fluoropiperidine, is an organic compound with a fluorine atom attached to the piperidine ring. It is characterized by its unique chemical structure and properties, making it a valuable compound for various applications in different industries.
Uses
Used in Pharmaceutical Industry:
3-FLUOROPIPERIDINE is used as a potent and selective inhibitor for [application type] ubiquitin-like domain-containing C-terminal domain phosphatase 1 (UBLCP1) for [application reason] its ability to modulate the activity of this enzyme, which plays a crucial role in various cellular processes. This makes it a promising candidate for the development of new therapeutic strategies targeting diseases associated with the dysregulation of UBLCP1.
Used in Chemical Synthesis:
3-FLUOROPIPERIDINE can be used as a building block or intermediate in the synthesis of various pharmaceuticals, agrochemicals, and other specialty chemicals. Its unique chemical structure allows for the development of novel compounds with potential applications in different industries.
Used in Research and Development:
3-FLUOROPIPERIDINE serves as an important research tool in the field of medicinal chemistry and drug discovery. It can be used to study the structure-activity relationships of various compounds and to develop new inhibitors or modulators targeting UBLCP1 and other related enzymes.
Check Digit Verification of cas no
The CAS Registry Mumber 116574-75-5 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,6,5,7 and 4 respectively; the second part has 2 digits, 7 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 116574-75:
(8*1)+(7*1)+(6*6)+(5*5)+(4*7)+(3*4)+(2*7)+(1*5)=135
135 % 10 = 5
So 116574-75-5 is a valid CAS Registry Number.
InChI:InChI=1/C5H10FN.ClH/c6-5-2-1-3-7-4-5;/h5,7H,1-4H2;1H
116574-75-5Relevant articles and documents
Understanding the Conformational Behavior of Fluorinated Piperidines: The Origin of the Axial-F Preference
Nairoukh, Zackaria,Strieth-Kalthoff, Felix,Bergander, Klaus,Glorius, Frank
, p. 6141 - 6146 (2020)
Gaining an understanding of the conformational behavior of fluorinated compounds would allow for expansion of the current molecular design toolbox. In order to facilitate drug discovery efforts, a systematic survey of a series of diversely substituted and protected fluorinated piperidine derivatives has been carried out using NMR spectroscopy. Computational investigations reveal that, in addition to established delocalization forces such as charge–dipole interactions and hyperconjugation, solvation and solvent polarity play a major role. This work codifies a new design principle for conformationally rigid molecular scaffolds.
Accessing (Multi)Fluorinated Piperidines Using Heterogeneous Hydrogenation
Bergander, Klaus,Daniliuc, Constantin G.,Glorius, Frank,Heusler, Arne,Nairoukh, Zackaria,Wagener, Tobias
, p. 12052 - 12057 (2020/11/27)
Fluorinated piperidines are desirable motifs for pharmaceutical and agrochemical research. Nevertheless, general synthetic access remains out of reach. Herein, we describe a simple and robust cis-selective hydrogenation of abundant and cheap fluoropyridines to yield a broad scope of (multi)fluorinated piperidines. This protocol enables the chemoselective reduction of fluoropyridines while tolerating other (hetero)aromatic systems using a commercially available heterogenous catalyst. Fluorinated derivatives of important drug compounds are prepared, and a straightforward strategy for the synthesis of enantioenriched fluorinated piperidines is disclosed.
