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CS-W001157 4
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7-Amino-4-methyl-1H-indole-3-carbonitrile

  • CAS No. 289483-87-0

  • Cat. No. CS-0096448
  • Purity≥95%
  • MDL No.MFCD09955317

*For research and further manufacturing use only, not for direct human use.

7-Amino-4-methyl-1H-indole-3-carbonitrile|CS-0096448

Structure of 289483-87-0

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General Information

  • CAS No. 289483-87-0
  • Cat. No. CS-0096448
  • Purity ≥95%
  • MDL No. MFCD09955317
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉N₃
  • Molecular Weight 171.20
  • Synonym(s) 7-Amino-3cyano-4-methyl-1H-indole
  • SMILES N#CC1=CNC2=C1C(C)=CC=C2N

Description

7-Amino-4-methyl-1H-indole-3-carbonitrile features a fused indole scaffold with strategically positioned amino, methyl, and nitrile groups. This electron-rich heterocycle integrates readily into pharmaceutical scaffolds, offering enhanced solubility and metabolic stability in synthetic intermediates. The para-nitrogen functionality enables direct coupling reactions under mild conditions.

Application

7-Amino-4-methyl-1H-indole-3-carbonitrile serves as a versatile building block in medicinal chemistry, enabling efficient access to substituted indole scaffolds. Its amino and nitrile groups offer orthogonal reactivity for downstream functionalization, while the methyl substitution enhances metabolic stability. The compound exhibits good bench stability and facilitates straightforward purification, making it well-suited for iterative synthesis campaigns targeting kinase inhibitors and other bioactive heterocycles.

Synthesis

  • Route1

    References

    • US2007/37854 A1, ; Page/Page column 6 ;
  • Route2
    • In-stock
      4-Methyl-7-nitro-1H-indole-3-carbonitrile|CS-0096442
      289483-82-5
    • tert-Butyl (3-cyano-4-methyl-1H-indol-7-yl)carbamate|CS-0614083
      289483-86-9
    • ~%
    • In-stock
      7-Amino-4-methyl-1H-indole-3-carbonitrile|CS-0096448
      289483-87-0

    References

    • EP1258252 A1, ;
  • Route3
    • tert-Butyl (3-cyano-4-methyl-1H-indol-7-yl)carbamate|CS-0614083
      289483-86-9
    • ~%
    • In-stock
      7-Amino-4-methyl-1H-indole-3-carbonitrile|CS-0096448
      289483-87-0

    References

    • US2002/128480 A1, ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H319
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   65.6
  • LogP   1.9302
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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