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CS-W001157 4
Total: USD 88.00

N-(Pyridin-4-yl)isonicotinamide

  • CAS No. 64479-78-3

  • Cat. No. CS-0110804
  • Purity≥97%
  • MDL No.MFCD00454168

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

N-(Pyridin-4-yl)isonicotinamide|CS-0110804

Structure of 64479-78-3

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General Information

  • CAS No. 64479-78-3
  • Cat. No. CS-0110804
  • Purity ≥97%
  • MDL No. MFCD00454168
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₉N₃O
  • Molecular Weight 199.21
  • Synonym(s) N-(Pyridin-4-yl)pyridine-4-carboxamide
  • SMILES O=C(NC=1C=CN=CC1)C=2C=CN=CC2

Description

N-(Pyridin-4-yl)isonicotinamide features a dual pyridine architecture with orthogonal nitrogen donors, enabling strong coordination in metal-ligand frameworks. This rigid, planar scaffold integrates seamlessly into supramolecular assemblies and serves as a tunable ligand for catalytic systems requiring directional binding and electron density modulation.

Application

N-(Pyridin-4-yl)isonicotinamide serves as a versatile bifunctional building block in synthetic organic chemistry, enabling efficient construction of heterocyclic scaffolds and functionalized pharmaceutical intermediates. Its dual pyridine motifs provide orthogonal reactivity for transition metal-catalyzed coupling reactions and facilitate hydrogen bonding in supramolecular assemblies. The compound exhibits excellent bench stability, moderate solubility in common organic solvents, and clean purification via recrystallization, making it well-suited for iterative synthesis workflows in medicinal chemistry and process development.

Synthesis

  • Route1
    • null|null
      504-24-5
    • Isonicotinic acid Nicotinic Acid  Impurity|CS-0229405
      55-22-1
    • ~75%
    • In-stock
      N-(Pyridin-4-yl)isonicotinamide|CS-0110804
      64479-78-3

    References

    • Nebot, Vicent J.; Armengol, Jose; Smets, Johan; Prieto, Susana Fernandez; Escuder, Beatriu; Miravet, Juan F. Chemistry - A European Journal, 2012 , vol. 18, # 13 p. 4063 - 4072
  • Route2
    • null|null
      504-24-5
    • In-stock
      Isonicotinoyl chloride hydrochloride|CS-W017350
      39178-35-3
    • ~%
    • In-stock
      N-(Pyridin-4-yl)isonicotinamide|CS-0110804
      64479-78-3

    References

    • Gardner et al. Journal of Organic Chemistry, 1954 , vol. 19, p. 753,755

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-P405-P501

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Computational Chemistry Data

  • TPSA   54.88
  • LogP   1.7289
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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