Cas no 630125-69-8 (4-(4-aminophenoxy)pyridine-2-carbonitrile)

4-(4-Aminophenoxy)pyridine-2-carbonitrile is a versatile heterocyclic compound featuring both pyridine and aniline moieties, linked by an ether bridge. Its structure combines an electron-rich aminophenoxy group with an electron-deficient pyridine-carbonitrile unit, making it a valuable intermediate in organic synthesis and pharmaceutical research. The presence of reactive functional groups (amine and nitrile) allows for further derivatization, enabling applications in the development of dyes, ligands, and bioactive molecules. Its stability under standard conditions and compatibility with various reaction conditions enhance its utility in multi-step synthetic routes. This compound is particularly useful in constructing complex heterocyclic frameworks for medicinal chemistry and materials science applications.
4-(4-aminophenoxy)pyridine-2-carbonitrile structure
630125-69-8 structure
Product Name:4-(4-aminophenoxy)pyridine-2-carbonitrile
CAS No:630125-69-8
MF:C12H9N3O
MW:211.219362020493
MDL:MFCD08447089
CID:1646480
PubChem ID:53399142
Update Time:2025-06-08

4-(4-aminophenoxy)pyridine-2-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 2-Pyridinecarbonitrile, 4-(4-aminophenoxy)-
    • 4-(4-amino-phenoxy)-pyridine-2-carbonitrile
    • 4-(4-aminophenoxy)pyridine-2-carbonitrile
    • 4-(4-Aminophenoxy)picolinonitrile
    • C77554
    • SY202427
    • Z1041133604
    • 4-(4-AMINOPHENOXY)-2-PYRIDINECARBONITRILE
    • 630125-69-8
    • AKOS012222695
    • SCHEMBL1642799
    • 4-(4-Aminophenoxy) pyridine-2-carbonitrile
    • 4-(4-aminophenoxy)-2-pyridinecarbonitrile, AldrichCPR
    • GRAZISXKEOERSH-UHFFFAOYSA-N
    • EN300-215974
    • CS-0139489
    • MFCD08447089
    • DB-331653
    • SB38017
    • MDL: MFCD08447089
    • Inchi: 1S/C12H9N3O/c13-8-10-7-12(5-6-15-10)16-11-3-1-9(14)2-4-11/h1-7H,14H2
    • InChI Key: GRAZISXKEOERSH-UHFFFAOYSA-N
    • SMILES: O(C1C=CN=C(C#N)C=1)C1C=CC(=CC=1)N

Computed Properties

  • Exact Mass: 211.07467
  • Monoisotopic Mass: 211.074561919g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 265
  • 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: 1.8
  • Topological Polar Surface Area: 71.9?2

Experimental Properties

  • PSA: 71.93

4-(4-aminophenoxy)pyridine-2-carbonitrile Pricemore >>

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Additional information on 4-(4-aminophenoxy)pyridine-2-carbonitrile

Comprehensive Overview of 4-(4-aminophenoxy)pyridine-2-carbonitrile (CAS No. 630125-69-8)

4-(4-aminophenoxy)pyridine-2-carbonitrile (CAS No. 630125-69-8) is a specialized organic compound that has garnered significant attention in pharmaceutical and material science research. This compound, characterized by its unique pyridine-carbonitrile core and aminophenoxy substituent, serves as a versatile intermediate in the synthesis of advanced materials and bioactive molecules. Its molecular structure, combining electron-rich and electron-deficient moieties, makes it particularly valuable for applications in drug discovery, organic electronics, and catalysis.

In recent years, the demand for 4-(4-aminophenoxy)pyridine-2-carbonitrile has surged due to its role in developing kinase inhibitors and heterocyclic compounds. Researchers are particularly interested in its potential to modulate protein-protein interactions, a hot topic in targeted cancer therapies. The compound's nitrile group also offers reactivity for further functionalization, aligning with the growing trend of click chemistry and bioorthogonal reactions in medicinal chemistry.

From a material science perspective, CAS No. 630125-69-8 is explored for its optoelectronic properties. Its conjugated system and donor-acceptor architecture make it a candidate for organic light-emitting diodes (OLEDs) and photovoltaic cells. This aligns with the global push toward sustainable energy solutions, a frequently searched topic in scientific and industrial communities. The compound's thermal stability and solubility profile further enhance its applicability in thin-film technologies.

Synthetic routes to 4-(4-aminophenoxy)pyridine-2-carbonitrile often involve Pd-catalyzed cross-coupling or nucleophilic aromatic substitution, reflecting advancements in green chemistry methodologies. Researchers frequently search for solvent-free synthesis or microwave-assisted reactions to improve yield and reduce environmental impact—a priority in modern chemical manufacturing.

Quality control of CAS No. 630125-69-8 relies on advanced analytical techniques such as HPLC-MS and NMR spectroscopy, addressing the industry's focus on purity standards and regulatory compliance. The compound's stability under various pH conditions is another area of investigation, particularly for formulation scientists working on oral drug delivery systems.

In summary, 4-(4-aminophenoxy)pyridine-2-carbonitrile represents a nexus of innovation across multiple disciplines. Its adaptability to structure-activity relationship (SAR) studies and compatibility with high-throughput screening platforms position it as a critical tool for addressing contemporary challenges in precision medicine and smart materials development.

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