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CAS 54329-29-2

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2-amino-4,5-dimethyl-1-phenyl-1H-pyrrole-3-carbonitrile

Description:
2-Amino-4,5-dimethyl-1-phenyl-1H-pyrrole-3-carbonitrile is a heterocyclic organic compound characterized by its pyrrole ring structure, which is a five-membered aromatic ring containing nitrogen. This compound features an amino group (-NH2) and a carbonitrile group (-C≡N) that contribute to its reactivity and potential applications in organic synthesis and medicinal chemistry. The presence of two methyl groups at the 4 and 5 positions of the pyrrole ring enhances its lipophilicity and may influence its biological activity. The phenyl group attached to the pyrrole ring can provide additional stability and may participate in π-π stacking interactions, which are important in drug design. The compound's unique structure allows for various substitution patterns, making it a candidate for further functionalization. Its CAS number, 54329-29-2, is a unique identifier that facilitates its recognition in chemical databases. Overall, this compound's characteristics suggest potential utility in pharmaceuticals, particularly in the development of new therapeutic agents.
Formula:C13H13N3
InChI:InChI=1/C13H13N3/c1-9-10(2)16(13(15)12(9)8-14)11-6-4-3-5-7-11/h3-7H,15H2,1-2H3
SMILES:Cc1c(C)n(c2ccccc2)c(c1C#N)N
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