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CAS 101831-76-9

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3-(azepan-1-ylmethyl)-1H-indole-5-carbonitrile

Description:
3-(Azepan-1-ylmethyl)-1H-indole-5-carbonitrile is a chemical compound characterized by its indole core, which is a bicyclic structure consisting of a benzene ring fused to a pyrrole ring. The presence of a carbonitrile group (-C≡N) at the 5-position of the indole contributes to its reactivity and potential applications in organic synthesis and medicinal chemistry. The azepan-1-ylmethyl substituent indicates that the compound contains a seven-membered nitrogen-containing ring (azepane) linked to the indole structure, which may influence its biological activity and solubility. This compound may exhibit properties such as being a potential ligand for biological targets, and its structural features suggest it could be investigated for pharmacological applications. Additionally, the presence of both the carbonitrile and azepane moieties may enhance its interaction with various biological systems, making it a candidate for further research in drug development. As with many indole derivatives, the compound's characteristics can be influenced by its stereochemistry and the specific functional groups present.
Formula:C16H19N3
InChI:InChI=1/C16H19N3/c17-10-13-5-6-16-15(9-13)14(11-18-16)12-19-7-3-1-2-4-8-19/h5-6,9,11,18H,1-4,7-8,12H2
SMILES:C1CCCN(CC1)Cc1c[nH]c2ccc(cc12)C#N
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