3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine

C17H12N2O — CID 10106673

IUPAC3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine
SMILESc1ccc(-c2cnc3[nH]cc(-c4ccoc4)c3c2)cc1
InChIInChI=1S/C17H12N2O/c1-2-4-12(5-3-1)14-8-15-16(13-6-7-20-11-13)10-19-17(15)18-9-14/h1-11H,(H,18,19)
InChIKeyOIOAVMZPLUJALD-UHFFFAOYSA-N
MW260.30 g/mol
LogP4.49
Rot. Bonds2

About 3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine

3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine (PubChem CID 10106673) has the molecular formula C17H12N2O and a molecular weight of 260.30 g/mol. Its IUPAC name is 3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine
PubChem CID10106673
Molecular FormulaC17H12N2O
Molecular Weight260.30 g/mol
Exact Mass260.09
IUPAC Name3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine
SMILESc1ccc(-c2cnc3[nH]cc(-c4ccoc4)c3c2)cc1
InChIInChI=1S/C17H12N2O/c1-2-4-12(5-3-1)14-8-15-16(13-6-7-20-11-13)10-19-17(15)18-9-14/h1-11H,(H,18,19)
InChIKeyOIOAVMZPLUJALD-UHFFFAOYSA-N
XLogP4.49
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine (CID 10106673) is 3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine is c1ccc(-c2cnc3[nH]cc(-c4ccoc4)c3c2)cc1.
What is the InChIKey of 3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is OIOAVMZPLUJALD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O/c1-2-4-12(5-3-1)14-8-15-16(13-6-7-20-11-13)10-19-17(15)18-9-14/h1-11H,(H,18,19).
What are the key properties of 3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine?
3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 260.30 g/mol, XLogP of 4.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-3-yl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 10106673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).