Cas no 13691-84-4 (3'-Trifluoromethylcyclopentanecarboxanilide)

3'-Trifluoromethylcyclopentanecarboxanilide structure
13691-84-4 structure
Product Name:3'-Trifluoromethylcyclopentanecarboxanilide
CAS No:13691-84-4
MF:C13H14F3NO
MW:257.251574039459
CID:230391
PubChem ID:139545
Update Time:2025-07-23

3'-Trifluoromethylcyclopentanecarboxanilide Chemical and Physical Properties

Names and Identifiers

    • Cyclopentanecarboxamide,N-[3-(trifluoromethyl)phenyl]-
    • 3'-(Trifluoromethyl)cyclopentanecarboxanilide
    • 3'-TRIFLUOROMETHYLCYCLOPENTANECARBOXANILIDE
    • cyclopentyl-N-[3-(trifluoromethyl)phenyl]carboxamide
    • TIMTEC-BB SBB008099
    • N-[3-(Trifluoromethyl)phenyl]cyclopentanecarboxamide
    • FT-0616419
    • N-(3-(Trifluoromethyl)phenyl)cyclopentanecarboxamide
    • 13691-84-4
    • 3/'-Trifluoromethylcyclopentanecarboxanilide
    • N-[3-(Trifluoromethyl)phenyl]cyclopentanecarboxamide #
    • SCHEMBL19638388
    • MFCD00043472
    • AKOS003869123
    • DTXSID10160003
    • A807162
    • DTXCID0082494
    • 3'-Trifluoromethylcyclopentanecarboxanilide
    • MDL: MFCD00043472
    • Inchi: 1S/C13H14F3NO/c14-13(15,16)10-6-3-7-11(8-10)17-12(18)9-4-1-2-5-9/h3,6-9H,1-2,4-5H2,(H,17,18)
    • InChI Key: PPEXRKPFMAVBPF-UHFFFAOYSA-N
    • SMILES: FC(C1=CC=CC(=C1)NC(C1CCCC1)=O)(F)F

Computed Properties

  • Exact Mass: 257.10300
  • Monoisotopic Mass: 257.102749
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 4
  • Complexity: 297
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.1
  • Topological Polar Surface Area: 29.1

Experimental Properties

  • Density: 1.281
  • Boiling Point: 367°Cat760mmHg
  • Flash Point: 175.7°C
  • Refractive Index: 1.527
  • PSA: 29.10000
  • LogP: 3.90710

3'-Trifluoromethylcyclopentanecarboxanilide Security Information

  • Hazard Statement: Irritant
  • Hazardous Material Identification: Xi

3'-Trifluoromethylcyclopentanecarboxanilide Customs Data

  • HS CODE:2924299090
  • Customs Data:

    China Customs Code:

    2924299090

    Overview:

    2924299090. Other cyclic amides(Including cyclic carbamates)(Including their derivatives as well as their salts). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, packing

    Summary:

    2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

3'-Trifluoromethylcyclopentanecarboxanilide Pricemore >>

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Additional information on 3'-Trifluoromethylcyclopentanecarboxanilide

Recent Advances in the Study of 3'-Trifluoromethylcyclopentanecarboxanilide (CAS: 13691-84-4)

3'-Trifluoromethylcyclopentanecarboxanilide (CAS: 13691-84-4) is a compound of significant interest in the field of chemical biology and pharmaceutical research. Recent studies have focused on its potential applications in drug development, particularly due to its unique structural properties and biological activity. This research brief aims to summarize the latest findings related to this compound, including its synthesis, mechanism of action, and therapeutic potential.

One of the key areas of investigation has been the synthesis and optimization of 3'-Trifluoromethylcyclopentanecarboxanilide. Researchers have developed novel synthetic routes to improve yield and purity, which are critical for scaling up production for preclinical and clinical studies. Recent publications highlight the use of advanced catalytic methods and green chemistry principles to achieve these goals, reducing environmental impact while maintaining high efficiency.

In terms of biological activity, 3'-Trifluoromethylcyclopentanecarboxanilide has shown promising results in targeting specific enzymes and receptors involved in inflammatory and oncogenic pathways. For instance, a 2023 study demonstrated its efficacy as a selective inhibitor of cyclooxygenase-2 (COX-2), a key enzyme in the inflammatory response. This finding suggests potential applications in the treatment of chronic inflammatory diseases, such as rheumatoid arthritis and inflammatory bowel disease.

Another significant development is the exploration of 3'-Trifluoromethylcyclopentanecarboxanilide as a potential anticancer agent. Preclinical studies have revealed its ability to induce apoptosis in certain cancer cell lines, particularly those resistant to conventional chemotherapy. The compound's mechanism of action appears to involve the modulation of apoptotic signaling pathways, making it a candidate for combination therapies with existing anticancer drugs.

Despite these promising findings, challenges remain in the development of 3'-Trifluoromethylcyclopentanecarboxanilide as a therapeutic agent. Issues such as bioavailability, metabolic stability, and potential off-target effects need to be addressed through further research. Recent efforts have focused on structural modifications to enhance pharmacokinetic properties while retaining biological activity.

In conclusion, 3'-Trifluoromethylcyclopentanecarboxanilide (CAS: 13691-84-4) represents a compound with substantial potential in drug discovery and development. Ongoing research is expected to provide deeper insights into its therapeutic applications and optimize its properties for clinical use. The integration of computational modeling, high-throughput screening, and advanced synthetic techniques will likely play a pivotal role in advancing this compound toward clinical trials.

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