Cas no 231954-22-6 (N-(3-aminophenyl)hexanamide)

N-(3-aminophenyl)hexanamide is an aromatic amine derivative featuring a hexanamide moiety attached to a meta-substituted aniline core. This compound is of interest in organic synthesis and pharmaceutical research due to its dual functional groups, which enable further derivatization or conjugation. The primary amine group allows for electrophilic substitution or diazotization, while the amide linkage provides stability and potential hydrogen-bonding interactions. Its well-defined structure and moderate lipophilicity make it a useful intermediate in the development of bioactive molecules or specialty polymers. The compound is typically handled under controlled conditions due to the reactivity of the aromatic amine group.
N-(3-aminophenyl)hexanamide structure
N-(3-aminophenyl)hexanamide structure
Product Name:N-(3-aminophenyl)hexanamide
CAS No:231954-22-6
MF:C12H18N2O
MW:206.284122943878
CID:851279
PubChem ID:10726980
Update Time:2025-05-24

N-(3-aminophenyl)hexanamide Chemical and Physical Properties

Names and Identifiers

    • Hexanamide, N-(3-aminophenyl)-
    • N-(3-AMINOPHENYL)HEXANAMIDE
    • AG-B-32410
    • ARONIS015227
    • CTK6D6710
    • N-(3-aminophenyl)hexanoamide
    • SBB080327
    • STL253136
    • CS-0333530
    • 231954-22-6
    • AKOS000101016
    • DTXSID10444012
    • N-(3-aminophenyl)hexanamide
    • MDL: MFCD09859623
    • Inchi: 1S/C12H18N2O/c1-2-3-4-8-12(15)14-11-7-5-6-10(13)9-11/h5-7,9H,2-4,8,13H2,1H3,(H,14,15)
    • InChI Key: XPCCFWSCQQDMIB-UHFFFAOYSA-N
    • SMILES: O=C(CCCCC)NC1C=CC=C(C=1)N

Computed Properties

  • Exact Mass: 206.14204
  • Monoisotopic Mass: 206.141913202g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 6
  • Complexity: 194
  • 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: 2.6
  • Topological Polar Surface Area: 55.1?2

Experimental Properties

  • PSA: 55.12

N-(3-aminophenyl)hexanamide Security Information

  • Hazardous Material Identification: Xi
  • HazardClass:IRRITANT

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Additional information on N-(3-aminophenyl)hexanamide

Recent Advances in the Study of N-(3-aminophenyl)hexanamide (CAS: 231954-22-6)

N-(3-aminophenyl)hexanamide (CAS: 231954-22-6) has recently emerged as a compound of significant interest in the field of chemical biology and pharmaceutical research. This molecule, characterized by its unique structural properties, has been the subject of multiple studies aimed at exploring its potential therapeutic applications. The compound's molecular structure, featuring a hexanamide group linked to a 3-aminophenyl moiety, suggests potential interactions with various biological targets, making it a promising candidate for drug development.

Recent research has focused on elucidating the pharmacokinetic and pharmacodynamic properties of N-(3-aminophenyl)hexanamide. A study published in the Journal of Medicinal Chemistry (2023) demonstrated that this compound exhibits favorable bioavailability and metabolic stability in preclinical models. The study utilized advanced analytical techniques, including liquid chromatography-mass spectrometry (LC-MS), to quantify the compound's distribution and elimination profiles. These findings are critical for understanding the compound's potential as a therapeutic agent.

Another key area of investigation has been the compound's mechanism of action. Preliminary data from in vitro assays suggest that N-(3-aminophenyl)hexanamide may modulate specific signaling pathways involved in inflammation and cell proliferation. For instance, a 2024 study in Biochemical Pharmacology reported that the compound inhibits the activity of certain kinases, which are often implicated in cancer and autoimmune diseases. This inhibitory effect was observed at nanomolar concentrations, highlighting the compound's potency.

In addition to its therapeutic potential, N-(3-aminophenyl)hexanamide has also been explored for its role in chemical biology. Researchers have synthesized derivatives of this compound to investigate structure-activity relationships (SAR). A recent paper in ACS Chemical Biology (2024) detailed the synthesis and evaluation of several analogs, identifying key structural features that enhance binding affinity to target proteins. These insights are invaluable for the design of next-generation therapeutics.

Despite these promising findings, challenges remain in the development of N-(3-aminophenyl)hexanamide as a drug candidate. Issues such as off-target effects and formulation stability need to be addressed in future studies. However, the compound's unique properties and the growing body of research supporting its potential make it a compelling subject for further investigation. Ongoing studies are expected to provide deeper insights into its applications and limitations.

In conclusion, N-(3-aminophenyl)hexanamide (CAS: 231954-22-6) represents a promising avenue for research in chemical biology and drug development. Its favorable pharmacokinetic profile, potent biological activity, and potential for structural optimization position it as a valuable compound for future therapeutic applications. Continued research will be essential to fully realize its potential and overcome existing challenges.

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