Cas no 797814-03-0 (5-Amino-2-pyrrolidin-1-yl-benzamide)

5-Amino-2-pyrrolidin-1-yl-benzamide structure
797814-03-0 structure
Product Name:5-Amino-2-pyrrolidin-1-yl-benzamide
CAS No:797814-03-0
MF:C11H15N3O
MW:205.256302118301
CID:1074791
PubChem ID:652625
Update Time:2025-10-29

5-Amino-2-pyrrolidin-1-yl-benzamide Chemical and Physical Properties

Names and Identifiers

    • 5-Amino-2-pyrrolidin-1-yl-benzamide
    • CHEMBL1366915
    • SCHEMBL17774819
    • MLS000027871
    • 5-amino-2-pyrrolidino-benzamide
    • SMR000013037
    • cid_652625
    • 5-azanyl-2-pyrrolidin-1-yl-benzamide
    • 5-amino-2-(1-pyrrolidinyl)benzamide
    • CS-0315586
    • SR-01000324657
    • HMS2334O15
    • HMS1695O05
    • SR-01000324657-1
    • VS-09814
    • 797814-03-0
    • DTXSID001292486
    • 5-amino-2-(pyrrolidin-1-yl)benzamide
    • AKOS000300639
    • 5-amino-2-pyrrolidin-1-ylbenzamide
    • BDBM39859
    • BBL030446
    • STL253527
    • MDL: MFCD06010207
    • Inchi: 1S/C11H15N3O/c12-8-3-4-10(9(7-8)11(13)15)14-5-1-2-6-14/h3-4,7H,1-2,5-6,12H2,(H2,13,15)
    • InChI Key: ZGAKJYKEQQWIJS-UHFFFAOYSA-N
    • SMILES: O=C(C1C=C(C=CC=1N1CCCC1)N)N

Computed Properties

  • Exact Mass: 205.121512110g/mol
  • Monoisotopic Mass: 205.121512110g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 238
  • 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: 0.7
  • Topological Polar Surface Area: 72.4?2

5-Amino-2-pyrrolidin-1-yl-benzamide Security Information

  • HazardClass:IRRITANT

5-Amino-2-pyrrolidin-1-yl-benzamide Pricemore >>

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Additional information on 5-Amino-2-pyrrolidin-1-yl-benzamide

5-Amino-2-pyrrolidin-1-yl-benzamide (CAS 797814-03-0): A Comprehensive Overview of Properties, Applications, and Research Trends

5-Amino-2-pyrrolidin-1-yl-benzamide, with the CAS number 797814-03-0, is a specialized organic compound that has garnered significant attention in pharmaceutical and biochemical research due to its unique structural features and potential applications. This compound belongs to the class of benzamide derivatives, characterized by the presence of an amino group and a pyrrolidine ring, which contribute to its distinct chemical behavior and biological activity. Researchers and industry professionals often search for terms like 5-Amino-2-pyrrolidin-1-yl-benzamide synthesis, CAS 797814-03-0 properties, and benzamide derivatives in drug discovery, reflecting a growing interest in its role in advancing therapeutic innovations. In this article, we delve into the molecular structure, physicochemical properties, applications, and current research trends, while aligning with SEO best practices to address common queries such as "What is the mechanism of action of 5-Amino-2-pyrrolidin-1-yl-benzamide?" and "How is it used in modern pharmacology?"

The molecular structure of 5-Amino-2-pyrrolidin-1-yl-benzamide consists of a benzamide core substituted with an amino group at the 5-position and a pyrrolidin-1-yl moiety at the 2-position. This arrangement imparts moderate polarity and solubility in organic solvents like dimethyl sulfoxide (DMSO) and ethanol, with a molecular weight of approximately 219.27 g/mol. Key physicochemical properties include a melting point range of 150-155°C and a logP value around 1.5, indicating balanced lipophilicity that facilitates membrane permeability in biological systems. These characteristics make it a valuable intermediate in synthetic chemistry, particularly for designing compounds with enhanced bioavailability. Searches for benzamide solubility and pyrrolidine-containing compounds are prevalent among chemists aiming to optimize reaction conditions or predict behavior in various environments, underscoring the compound's relevance in laboratory settings.

In terms of applications, 5-Amino-2-pyrrolidin-1-yl-benzamide is primarily utilized in pharmaceutical research as a building block for developing novel therapeutic agents. Its structural motifs are often incorporated into molecules targeting neurological disorders, inflammation, and metabolic diseases, leveraging the pyrrolidine ring's ability to interact with biological receptors. For instance, it serves as a precursor in the synthesis of kinase inhibitors and GPCR modulators, which are hotspots in drug discovery due to their potential in treating conditions like Alzheimer's disease and diabetes. Online queries such as benzamide derivatives in neuroscience and CAS 797814-03-0 applications highlight the compound's alignment with current healthcare trends, including personalized medicine and AI-driven drug design. Additionally, its use in biochemical assays for studying protein-ligand interactions makes it a staple in high-throughput screening, catering to the growing demand for efficient research tools in biotech industries.

The synthesis of 5-Amino-2-pyrrolidin-1-yl-benzamide typically involves multi-step organic reactions, starting from commercially available precursors like 2-nitrobenzoyl chloride. Common methods include nucleophilic substitution with pyrrolidine followed by reduction of the nitro group to an amino functionality, employing reagents such as tin chloride or catalytic hydrogenation. These processes are optimized for yield and purity, often discussed in scientific literature and patent filings. Researchers frequently search for synthesis of 5-Amino-2-pyrrolidin-1-yl-benzamide and optimization of benzamide reactions, reflecting a need for scalable and environmentally friendly protocols. Recent advancements focus on green chemistry approaches, such as using microwave-assisted synthesis or biodegradable catalysts, which resonate with broader societal concerns about sustainability and reduced environmental impact in chemical manufacturing.

Market dynamics and research trends for 5-Amino-2-pyrrolidin-1-yl-benzamide are influenced by its potential in emerging fields like precision medicine and computational biology. With the rise of AI and machine learning in drug development, this compound is increasingly studied in silico for virtual screening and molecular docking simulations. Queries like AI in benzamide research and computational modeling of CAS 797814-03-0 are gaining traction, as scientists seek to predict efficacy and toxicity before experimental validation. The global market for such intermediates is expanding, driven by investments in pharmaceutical R&D and collaborations between academia and industry. Regulatory aspects ensure compliance with safety standards, avoiding any association with restricted substances, which aligns with searches for safe handling of research chemicals and regulatory guidelines for benzamides.

Looking ahead, 5-Amino-2-pyrrolidin-1-yl-benzamide holds promise for future innovations, particularly in addressing unmet medical needs through targeted therapies. Its integration with cutting-edge technologies like CRISPR and organ-on-a-chip models could revolutionize disease modeling and drug testing. As users often inquire about future of benzamide derivatives and innovations in pharmaceutical intermediates, this compound exemplifies the intersection of traditional chemistry and modern science. By maintaining a focus on ethical research practices and avoiding any controversial applications, it remains a valuable asset in the scientific community, contributing to advancements that benefit human health and well-being.

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