Cas no 873055-07-3 (6-amino-1H-Indole-2-carbonitrile)
6-amino-1H-Indole-2-carbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 6-amino-1H-Indole-2-carbonitrile
- 1H-Indole-2-carbonitrile,6-amino-
- 1H-Indole-2-carbonitrile,6-amino-(9CI)
- 6-Amino-1H-indole-2-carbonitrile (ACI)
- MNEBAWCHNGDKOY-UHFFFAOYSA-N
- 873055-07-3
- AS-81808
- CS-0163661
- SCHEMBL393268
- E82024
- DTXSID50668538
- EN300-7827511
-
- Inchi: 1S/C9H7N3/c10-5-8-3-6-1-2-7(11)4-9(6)12-8/h1-4,12H,11H2
- InChI Key: MNEBAWCHNGDKOY-UHFFFAOYSA-N
- SMILES: N#CC1NC2C(=CC=C(C=2)N)C=1
Computed Properties
- Exact Mass: 157.064
- Monoisotopic Mass: 157.064
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 217
- 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
- Topological Polar Surface Area: 65.6A^2
- XLogP3: 1.4
6-amino-1H-Indole-2-carbonitrile Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| eNovation Chemicals LLC | Y1256585-100mg |
1H-Indole-2-carbonitrile,6-amino- |
873055-07-3 | 97% | 100mg |
$265 | 2024-06-07 | |
| eNovation Chemicals LLC | Y1256585-250mg |
1H-Indole-2-carbonitrile,6-amino- |
873055-07-3 | 97% | 250mg |
$440 | 2024-06-07 | |
| Enamine | EN300-7827511-0.05g |
6-amino-1H-indole-2-carbonitrile |
873055-07-3 | 95.0% | 0.05g |
$459.0 | 2025-03-21 | |
| Enamine | EN300-7827511-0.1g |
6-amino-1H-indole-2-carbonitrile |
873055-07-3 | 95.0% | 0.1g |
$600.0 | 2025-03-21 | |
| Enamine | EN300-7827511-0.25g |
6-amino-1H-indole-2-carbonitrile |
873055-07-3 | 95.0% | 0.25g |
$855.0 | 2025-03-21 | |
| Enamine | EN300-7827511-0.5g |
6-amino-1H-indole-2-carbonitrile |
873055-07-3 | 95.0% | 0.5g |
$1349.0 | 2025-03-21 | |
| Enamine | EN300-7827511-1.0g |
6-amino-1H-indole-2-carbonitrile |
873055-07-3 | 95.0% | 1.0g |
$1729.0 | 2025-03-21 | |
| Enamine | EN300-7827511-2.5g |
6-amino-1H-indole-2-carbonitrile |
873055-07-3 | 95.0% | 2.5g |
$3389.0 | 2025-03-21 | |
| Enamine | EN300-7827511-5.0g |
6-amino-1H-indole-2-carbonitrile |
873055-07-3 | 95.0% | 5.0g |
$5014.0 | 2025-03-21 | |
| Enamine | EN300-7827511-10.0g |
6-amino-1H-indole-2-carbonitrile |
873055-07-3 | 95.0% | 10.0g |
$7435.0 | 2025-03-21 |
6-amino-1H-Indole-2-carbonitrile Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
Additional information on 6-amino-1H-Indole-2-carbonitrile
Introduction to 6-amino-1H-Indole-2-carbonitrile (CAS No. 873055-07-3)
6-amino-1H-Indole-2-carbonitrile, identified by its Chemical Abstracts Service (CAS) number 873055-07-3, is a heterocyclic organic compound that has garnered significant attention in the field of pharmaceutical chemistry and medicinal biology. This compound belongs to the indole family, a structural motif widely recognized for its biological activity and pharmaceutical relevance. The presence of both an amino group and a nitrile group in its molecular structure makes it a versatile intermediate, facilitating diverse chemical transformations and functionalization strategies.
The indole core is a prominent scaffold in natural products and pharmacologically active molecules, contributing to its extensive utility in drug discovery. Specifically, 6-amino-1H-Indole-2-carbonitrile has been explored as a key building block in the synthesis of various bioactive compounds. Its structural features allow for modifications that can enhance binding affinity to biological targets, making it a valuable reagent in the development of novel therapeutic agents.
In recent years, there has been growing interest in indole derivatives due to their demonstrated efficacy across multiple therapeutic areas. Research has highlighted the potential of 6-amino-1H-Indole-2-carbonitrile in the design of molecules targeting neurological disorders, infectious diseases, and cancer. The nitrile group, in particular, serves as a versatile handle for further functionalization, enabling the synthesis of complex derivatives with tailored properties.
One of the most compelling aspects of 6-amino-1H-Indole-2-carbonitrile is its role as a precursor in the synthesis of indole-based drugs that have shown promise in preclinical studies. For instance, derivatives of this compound have been investigated for their ability to modulate enzyme activity and receptor binding. The amino group provides a site for further derivatization, allowing chemists to introduce additional functional moieties that can enhance pharmacokinetic profiles or target specific biological pathways.
The pharmaceutical industry has increasingly relied on heterocyclic compounds like indoles due to their favorable pharmacological properties. 6-amino-1H-Indole-2-carbonitrile exemplifies this trend, as it serves as a cornerstone in the synthesis of molecules with potential therapeutic applications. Its structural flexibility allows for the creation of diverse analogs, each with unique biological activities. This adaptability has made it a staple in synthetic chemistry laboratories focused on drug discovery.
Recent advancements in computational chemistry have further enhanced the utility of 6-amino-1H-Indole-2-carbonitrile. Molecular modeling studies have revealed insights into how modifications at the 2-position and 6-position can influence biological activity. These findings have guided the rational design of new derivatives with improved efficacy and reduced toxicity. The integration of machine learning algorithms has also accelerated the process of identifying promising candidates for further experimental validation.
In addition to its pharmaceutical applications, 6-amino-1H-Indole-2-carbonitrile has found utility in materials science and agrochemical research. Its ability to serve as a precursor for more complex molecules makes it valuable beyond traditional drug development contexts. Researchers have explored its use in creating novel polymers and functional materials, leveraging its indole core for enhanced stability and reactivity.
The synthesis of 6-amino-1H-Indole-2-carbonitrile itself is an area of active investigation. Modern synthetic methodologies have enabled more efficient and scalable production processes, reducing costs and improving yields. Catalytic approaches, including transition metal-catalyzed reactions, have been particularly effective in constructing the indole framework with high precision. These advancements ensure that researchers have access to sufficient quantities of this compound for their studies.
The safety profile of 6-amino-1H-Indole-2-carbonitrile is another critical consideration in its application. While it is not classified as a hazardous material under standard regulatory frameworks, proper handling protocols are essential to ensure safe laboratory practices. Storage conditions, such as temperature control and moisture protection, are crucial to maintaining its integrity during use.
The future prospects for 6-amino-1H-Indole-2-carbonitrile are promising, given its versatility and broad applicability. As drug discovery continues to evolve, this compound is likely to remain a key intermediate in the development of new therapies. Collaborative efforts between academia and industry will continue to drive innovation, leveraging its unique chemical properties to address unmet medical needs.
In conclusion,6-amino-1H-Indole - 2 - carbonitrile (CAS No. 873055 - 07 - 3) stands as a pivotal compound in modern chemical biology and pharmaceutical research. Its structural features enable diverse functionalization strategies, making it indispensable for synthesizing bioactive molecules with potential therapeutic applications across various disease areas. The ongoing exploration of its synthetic pathways and biological activities underscores its significance as a cornerstone in medicinal chemistry.
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