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5-Methyl-1H-pyrrolo[2,3-c]pyridine-2-carboxylic acid

  • CAS No. 800401-91-6

  • Cat. No. CS-0152779
  • Molecule weight176.17
  • Purity≥98%
  • MDL No.MFCD18381017

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

5-Methyl-1H-pyrrolo[2,3-c]pyridine-2-carboxylic acid|CS-0152779

Structure of 800401-91-6

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General Information

  • CAS No. 800401-91-6
  • Cat. No. CS-0152779
  • Purity ≥98%
  • MDL No. MFCD18381017
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂O₂
  • Molecular Weight 176.17
  • Synonym(s) 5-Methyl-6-azaindole-2-carboxylic acid
  • SMILES CC1=NC=C2C(=C1)C=C(C(=O)O)N2

Description

This pyrrolopyridine carboxylic acid features a methyl-substituted heterocycle with a pendant acidic functional group, enabling integration into bioactive scaffolds. The electron-deficient core supports diverse coupling reactions, while the carboxylic acid facilitates derivatization and salt formation under standard conditions.

Application

5-Methyl-1H-pyrrolo[2,3-c]pyridine-2-carboxylic acid serves as a versatile heterocyclic building block for medicinal chemistry and materials science. Its carboxylic acid functionality enables direct amidation, esterification, and coupling reactions, while the fused pyrrole-pyridine core provides structural rigidity and moderate electron-rich character. The methyl group at C5 enhances metabolic stability and offers a site for further functionalization. This compound demonstrates good bench stability and facilitates purification via standard chromatographic or crystallization methods, making it suitable for scalable synthesis and API development workflows.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H317
Precautionary Statements : P261-P264-P270-P272-P280-P302+P352-P330-P362+P364-P501

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Computational Chemistry Data

  • TPSA   65.98
  • LogP   1.56952
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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