1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine

C13H9FN2 — CID 21262725

IUPAC1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine
SMILESFc1ccc(-n2ccc3cccnc32)cc1
InChIInChI=1S/C13H9FN2/c14-11-3-5-12(6-4-11)16-9-7-10-2-1-8-15-13(10)16/h1-9H
InChIKeyRSMQEPULRAGKEU-UHFFFAOYSA-N
MW212.23 g/mol
LogP3.16
Rot. Bonds1

About 1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine

1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine (PubChem CID 21262725) has the molecular formula C13H9FN2 and a molecular weight of 212.23 g/mol. Its IUPAC name is 1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine
PubChem CID21262725
Molecular FormulaC13H9FN2
Molecular Weight212.23 g/mol
Exact Mass212.07
IUPAC Name1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine
SMILESFc1ccc(-n2ccc3cccnc32)cc1
InChIInChI=1S/C13H9FN2/c14-11-3-5-12(6-4-11)16-9-7-10-2-1-8-15-13(10)16/h1-9H
InChIKeyRSMQEPULRAGKEU-UHFFFAOYSA-N
XLogP3.16
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.23
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine?
The IUPAC name of 1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine (CID 21262725) is 1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine?
The canonical SMILES for 1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine is Fc1ccc(-n2ccc3cccnc32)cc1.
What is the InChIKey of 1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine?
The InChIKey is RSMQEPULRAGKEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FN2/c14-11-3-5-12(6-4-11)16-9-7-10-2-1-8-15-13(10)16/h1-9H.
What are the key properties of 1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine?
1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine has a molecular weight of 212.23 g/mol, XLogP of 3.16, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 21262725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).