Cas no 215454-25-4 (1-Aminoisoquinoline-7-carbonitrile)

1-Aminoisoquinoline-7-carbonitrile is a heterocyclic organic compound featuring an amino group at the 1-position and a cyano substituent at the 7-position of the isoquinoline scaffold. This structure imparts versatility in synthetic applications, particularly as a key intermediate in pharmaceuticals and agrochemicals. The presence of both amino and cyano functional groups enables diverse reactivity, facilitating further derivatization through nucleophilic substitution or cyclization reactions. Its rigid aromatic core contributes to stability, while the electron-withdrawing cyano group enhances selectivity in cross-coupling reactions. The compound is valued for its potential in constructing biologically active molecules, including kinase inhibitors and antimicrobial agents, due to its balanced electronic and steric properties.
1-Aminoisoquinoline-7-carbonitrile structure
215454-25-4 structure
Product Name:1-Aminoisoquinoline-7-carbonitrile
CAS No:215454-25-4
MF:C10H7N3
MW:169.182681322098
MDL:MFCD16038637
CID:1027812
PubChem ID:22665848
Update Time:2025-05-22

1-Aminoisoquinoline-7-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 1-Aminoisoquinoline-7-carbonitrile
    • 7-ISOQUINOLINECARBONITRILE, 1-AMINO-
    • 1-Amino-isoquinoline-7-carbonitrile
    • A4633
    • SZNOIFCVHBOKDB-UHFFFAOYSA-N
    • AM85664
    • SCHEMBL6436605
    • EN300-268318
    • DTXSID80627436
    • AT37464
    • 215454-25-4
    • AKOS015901910
    • 7-Isoquinolinecarbonitrile,1-amino-
    • MDL: MFCD16038637
    • Inchi: 1S/C10H7N3/c11-6-7-1-2-8-3-4-13-10(12)9(8)5-7/h1-5H,(H2,12,13)
    • InChI Key: SZNOIFCVHBOKDB-UHFFFAOYSA-N
    • SMILES: N1C=CC2C=CC(C#N)=CC=2C=1N

Computed Properties

  • Exact Mass: 169.063997236g/mol
  • Monoisotopic Mass: 169.063997236g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 0
  • Complexity: 230
  • 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: 1.6
  • Topological Polar Surface Area: 62.7?2

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1-Aminoisoquinoline-7-carbonitrile Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:215454-25-4)1-Aminoisoquinoline-7-carbonitrile
Order Number:A4633
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 16:03
Price ($):652.0

Additional information on 1-Aminoisoquinoline-7-carbonitrile

1-Aminoisoquinoline-7-carbonitrile: A Comprehensive Overview

1-Aminoisoquinoline-7-carbonitrile (CAS No. 215454-25-4) is a compound of significant interest in the fields of organic chemistry, pharmacology, and materials science. This compound, characterized by its isoquinoline backbone with an amino group at position 1 and a cyano group at position 7, has garnered attention due to its unique structural features and potential applications in drug discovery and advanced materials. Recent studies have highlighted its role in various chemical reactions, as well as its potential as a building block for more complex molecules.

The synthesis of 1-Aminoisoquinoline-7-carbonitrile involves a series of carefully designed organic reactions. Researchers have explored methods such as nucleophilic substitution, coupling reactions, and cyclization processes to efficiently construct this compound. For instance, a recent study published in the *Journal of Organic Chemistry* demonstrated a novel approach utilizing palladium-catalyzed cross-coupling reactions to synthesize 1-Aminoisoquinoline-7-carbonitrile with high yield and purity. This method not only simplifies the synthesis process but also opens new avenues for the production of isoquinoline derivatives with diverse functional groups.

One of the most promising applications of 1-Aminoisoquinoline-7-carbonitrile lies in its use as an intermediate in drug discovery. Isoquinoline derivatives are known for their bioactive properties, and the presence of an amino group and a cyano group in this compound enhances its potential for interaction with biological targets. Recent research has shown that 1-Aminoisoquinoline-7-carbonitrile can serve as a precursor for molecules with anti-inflammatory, antitumor, and antimicrobial activities. For example, a study conducted by researchers at the University of California revealed that derivatives of this compound exhibit potent inhibitory effects on certain enzymes associated with neurodegenerative diseases.

In addition to its role in pharmacology, 1-Aminoisoquinoline-7-carbonitrile has also been explored for its applications in materials science. The compound's structural rigidity and ability to form hydrogen bonds make it a suitable candidate for the development of advanced materials such as coordination polymers and metal-organic frameworks (MOFs). A recent paper in *Nature Materials* highlighted how derivatives of this compound can be used to create MOFs with high surface area and porosity, which are valuable for gas storage and catalysis.

The study of 1-Aminoisoquinoline-7-carbonitrile has also contributed to our understanding of isoquinoline chemistry. Its reactivity patterns provide insights into the behavior of similar compounds under various reaction conditions. For instance, researchers have investigated the effect of substituents on the electronic properties of isoquinolines, leading to new strategies for controlling reactivity in organic synthesis. These findings have implications not only for the synthesis of 1-Aminoisoquinoline-7-carbonitrile but also for related compounds.

From an environmental standpoint, the synthesis and application of 1-Aminoisoquinoline-7-carbonitrile have been optimized to minimize ecological impact. Green chemistry principles have been incorporated into its production processes, reducing waste and energy consumption. This aligns with global efforts to promote sustainable practices in chemical manufacturing.

In conclusion, 1-Aminoisoquinoline-7-carbonitrile (CAS No. 215454-25-4) is a versatile compound with wide-ranging applications across multiple disciplines. Its unique structure, coupled with recent advancements in synthesis and application techniques, positions it as a valuable tool in both academic research and industrial development. As ongoing studies continue to uncover new properties and uses for this compound, its significance in the scientific community is expected to grow further.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:215454-25-4)1-Aminoisoquinoline-7-carbonitrile
A4633
Purity:99%
Quantity:1g
Price ($):652.0
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