2-phenyl-3H-pyrrolo[2,3-b]pyridine

C13H10N2 — CID 77231538

IUPAC2-phenyl-3H-pyrrolo[2,3-b]pyridine
SMILESc1ccc(C2=Nc3ncccc3C2)cc1
InChIInChI=1S/C13H10N2/c1-2-5-10(6-3-1)12-9-11-7-4-8-14-13(11)15-12/h1-8H,9H2
InChIKeyLLAZQZQCMZEQPV-UHFFFAOYSA-N
MW194.24 g/mol
LogP2.76
Rot. Bonds1

About 2-phenyl-3H-pyrrolo[2,3-b]pyridine

2-phenyl-3H-pyrrolo[2,3-b]pyridine (PubChem CID 77231538) has the molecular formula C13H10N2 and a molecular weight of 194.24 g/mol. Its IUPAC name is 2-phenyl-3H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name2-phenyl-3H-pyrrolo[2,3-b]pyridine
PubChem CID77231538
Molecular FormulaC13H10N2
Molecular Weight194.24 g/mol
Exact Mass194.08
IUPAC Name2-phenyl-3H-pyrrolo[2,3-b]pyridine
SMILESc1ccc(C2=Nc3ncccc3C2)cc1
InChIInChI=1S/C13H10N2/c1-2-5-10(6-3-1)12-9-11-7-4-8-14-13(11)15-12/h1-8H,9H2
InChIKeyLLAZQZQCMZEQPV-UHFFFAOYSA-N
XLogP2.76
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-3H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 2-phenyl-3H-pyrrolo[2,3-b]pyridine (CID 77231538) is 2-phenyl-3H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 2-phenyl-3H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 2-phenyl-3H-pyrrolo[2,3-b]pyridine is c1ccc(C2=Nc3ncccc3C2)cc1.
What is the InChIKey of 2-phenyl-3H-pyrrolo[2,3-b]pyridine?
The InChIKey is LLAZQZQCMZEQPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2/c1-2-5-10(6-3-1)12-9-11-7-4-8-14-13(11)15-12/h1-8H,9H2.
What are the key properties of 2-phenyl-3H-pyrrolo[2,3-b]pyridine?
2-phenyl-3H-pyrrolo[2,3-b]pyridine has a molecular weight of 194.24 g/mol, XLogP of 2.76, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-3H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 77231538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).