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2-(Methylamino)benzamide

  • CAS No. 7505-81-9

  • Cat. No. CS-0151026
  • Molecule weight150.18
  • Purity≥98%
  • MDL No.MFCD00025469

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

2-(Methylamino)benzamide|CS-0151026

Structure of 7505-81-9

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General Information

  • CAS No. 7505-81-9
  • Cat. No. CS-0151026
  • Purity ≥98%
  • MDL No. MFCD00025469
  • Storage RT, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₀N₂O
  • Molecular Weight 150.18
  • Synonym(s) o-(methylamino)-benzamid
  • SMILES CNC1=CC=CC=C1C(N)=O

Description

2-(Methylamino)benzamide features a methylamino group ortho to an amide functionality, enabling versatile integration into bioactive scaffolds. This substitution pattern enhances solubility and modulates electronic properties, facilitating use in medicinal chemistry campaigns targeting receptor-ligand interactions. The compound exhibits bench-stable handling characteristics under standard conditions.

Application

2-(Methylamino)benzamide serves as a versatile building block in medicinal chemistry, enabling the construction of bioactive heterocycles and pharmaceutical scaffolds. Its ortho-aminoamide functionality supports diverse transformations, including cyclizations, coupling reactions, and metal-catalyzed functionalizations. The compound exhibits good bench stability and facilitates straightforward purification, making it well-suited for iterative synthesis campaigns in drug discovery and process development.

Synthesis

  • Route1

    References

    • Guan, Zheng-Hui; Chen, Ming; Ren, Zhi-Hui Journal of the American Chemical Society, 2012 , vol. 134, # 42 p. 17490 - 17493,4
  • Route2
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    • In-stock
      2-(Methylamino)benzamide|CS-0151026
      7505-81-9

    References

    • Journal of the American Chemical Society, , vol. 134, # 42 p. 17490 - 17493,4
  • Route3

    References

    • Paleta, Oldrich; Dolensky, Bohumil; Palecek, Jiri; Kvicala, Jaroslav European Journal of Organic Chemistry, 2013 , # 7 p. 1262 - 1270

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   55.12
  • LogP   0.8272
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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