6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine

C11H6BrFN4 — CID 104639106

IUPAC6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine
SMILESFc1ccc(-c2nc3ncc(Br)cc3[nH]2)nc1
InChIInChI=1S/C11H6BrFN4/c12-6-3-9-10(15-4-6)17-11(16-9)8-2-1-7(13)5-14-8/h1-5H,(H,15,16,17)
InChIKeyGABQAGVVWFMTHJ-UHFFFAOYSA-N
MW293.10 g/mol
LogP2.92
Rot. Bonds1

About 6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine

6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 104639106) has the molecular formula C11H6BrFN4 and a molecular weight of 293.10 g/mol. Its IUPAC name is 6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine
PubChem CID104639106
Molecular FormulaC11H6BrFN4
Molecular Weight293.10 g/mol
Exact Mass291.98
IUPAC Name6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine
SMILESFc1ccc(-c2nc3ncc(Br)cc3[nH]2)nc1
InChIInChI=1S/C11H6BrFN4/c12-6-3-9-10(15-4-6)17-11(16-9)8-2-1-7(13)5-14-8/h1-5H,(H,15,16,17)
InChIKeyGABQAGVVWFMTHJ-UHFFFAOYSA-N
XLogP2.92
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.10
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine (CID 104639106) is 6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine is Fc1ccc(-c2nc3ncc(Br)cc3[nH]2)nc1.
What is the InChIKey of 6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is GABQAGVVWFMTHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6BrFN4/c12-6-3-9-10(15-4-6)17-11(16-9)8-2-1-7(13)5-14-8/h1-5H,(H,15,16,17).
What are the key properties of 6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine?
6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 293.10 g/mol, XLogP of 2.92, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(5-fluoro-2-pyridinyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 104639106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).