Cas no 1014613-55-8 (2-cyclobutyl-1H-Pyrrolo[2,3-b]pyridine)

2-cyclobutyl-1H-Pyrrolo[2,3-b]pyridine structure
1014613-55-8 structure
Product Name:2-cyclobutyl-1H-Pyrrolo[2,3-b]pyridine
CAS No:1014613-55-8
MF:C11H12N2
MW:172.226382255554
CID:1096314
PubChem ID:59744613
Update Time:2025-04-20

2-cyclobutyl-1H-Pyrrolo[2,3-b]pyridine Chemical and Physical Properties

Names and Identifiers

    • 2-cyclobutyl-1H-Pyrrolo[2,3-b]pyridine
    • 1H-Pyrrolo[2,3-b]pyridine, 2-cyclobutyl-
    • SCHEMBL3413988
    • 2-Cyclobutyl-1H-pyrrolo[2,3-b]pyridine, AldrichCPR
    • 1014613-55-8
    • ZYIUZWKLXOVOQL-UHFFFAOYSA-N
    • Inchi: 1S/C11H12N2/c1-3-8(4-1)10-7-9-5-2-6-12-11(9)13-10/h2,5-8H,1,3-4H2,(H,12,13)
    • InChI Key: ZYIUZWKLXOVOQL-UHFFFAOYSA-N
    • SMILES: N1C2C(=CC=CN=2)C=C1C1CCC1

Computed Properties

  • Exact Mass: 172.100048g/mol
  • Monoisotopic Mass: 172.100048g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 189
  • 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: 172.23g/mol
  • XLogP3: 2.4
  • Topological Polar Surface Area: 28.7?2
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