Cas no 267413-07-0 (1H,2H,3H-pyrrolo[2,3-b]pyridine-5-carbonitrile)

1H,2H,3H-pyrrolo[2,3-b]pyridine-5-carbonitrile is a heterocyclic organic compound featuring a fused pyrrolo[2,3-b]pyridine core with a nitrile functional group at the 5-position. This structure offers versatility as a building block in medicinal chemistry and agrochemical synthesis due to its electron-rich aromatic system and reactive cyano group. The compound is particularly valuable in the development of pharmaceuticals, serving as a key intermediate for biologically active molecules, including kinase inhibitors and other therapeutic agents. Its rigid scaffold enhances binding affinity in target interactions, while the nitrile group allows for further functionalization, enabling diverse derivatization pathways. Suitable for research and industrial applications requiring high-purity intermediates.
1H,2H,3H-pyrrolo[2,3-b]pyridine-5-carbonitrile structure
267413-07-0 structure
Product Name:1H,2H,3H-pyrrolo[2,3-b]pyridine-5-carbonitrile
CAS No:267413-07-0
MF:C8H7N3
MW:145.161280870438
MDL:MFCD06659757
CID:247843
PubChem ID:45079671
Update Time:2025-08-11

1H,2H,3H-pyrrolo[2,3-b]pyridine-5-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrrolo[2,3-b]pyridine-5-carbonitrile,2,3-dihydro-
    • 2,3-DIHYDRO-1H-PYRROLO[2,3-B]PYRIDINE-5-CARBONITRILE
    • 7-aza-5-cyanoindoline
    • AB26248
    • 1H,2H,3H-PYRROLO[2,3-B]PYRIDINE-5-CARBONITRILE
    • SCHEMBL1680438
    • MFCD06659757
    • 267413-07-0
    • DTXSID30663763
    • AKOS006293870
    • PS-20385
    • FT-0737434
    • P20983
    • 1H,2H,3H-pyrrolo[2,3-b]pyridine-5-carbonitrile
    • MDL: MFCD06659757
    • Inchi: 1S/C8H7N3/c9-4-6-3-7-1-2-10-8(7)11-5-6/h3,5H,1-2H2,(H,10,11)
    • InChI Key: UFNOCUCGEQCHBC-UHFFFAOYSA-N
    • SMILES: N1C2=C(C=C(C#N)C=N2)CC1

Computed Properties

  • Exact Mass: 145.06400
  • Monoisotopic Mass: 145.063997236 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 193
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Molecular Weight: 145.16
  • XLogP3: 0.9
  • Topological Polar Surface Area: 48.7

Experimental Properties

  • PSA: 48.71000
  • LogP: 1.05928

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1H,2H,3H-pyrrolo[2,3-b]pyridine-5-carbonitrile Suppliers

Amadis Chemical Company Limited
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(CAS:267413-07-0)1H,2H,3H-pyrrolo[2,3-b]pyridine-5-carbonitrile
Order Number:A950774
Stock Status:in Stock
Quantity:10g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 16:08
Price ($):2651.0
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Amadis Chemical Company Limited
(CAS:267413-07-0)1H,2H,3H-pyrrolo[2,3-b]pyridine-5-carbonitrile
A950774
Purity:99%
Quantity:10g
Price ($):2651.0
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