6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine

C12H7BrFN3 — CID 59815647

IUPAC6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine
SMILESFc1cccc(-n2cnc3cc(Br)cnc32)c1
InChIInChI=1S/C12H7BrFN3/c13-8-4-11-12(15-6-8)17(7-16-11)10-3-1-2-9(14)5-10/h1-7H
InChIKeyRLLPMDPDUCWEFB-UHFFFAOYSA-N
MW292.11 g/mol
LogP3.32
Rot. Bonds1

About 6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine

6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine (PubChem CID 59815647) has the molecular formula C12H7BrFN3 and a molecular weight of 292.11 g/mol. Its IUPAC name is 6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine
PubChem CID59815647
Molecular FormulaC12H7BrFN3
Molecular Weight292.11 g/mol
Exact Mass290.98
IUPAC Name6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine
SMILESFc1cccc(-n2cnc3cc(Br)cnc32)c1
InChIInChI=1S/C12H7BrFN3/c13-8-4-11-12(15-6-8)17(7-16-11)10-3-1-2-9(14)5-10/h1-7H
InChIKeyRLLPMDPDUCWEFB-UHFFFAOYSA-N
XLogP3.32
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.11
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine?
The IUPAC name of 6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine (CID 59815647) is 6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine?
The canonical SMILES for 6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine is Fc1cccc(-n2cnc3cc(Br)cnc32)c1.
What is the InChIKey of 6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine?
The InChIKey is RLLPMDPDUCWEFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7BrFN3/c13-8-4-11-12(15-6-8)17(7-16-11)10-3-1-2-9(14)5-10/h1-7H.
What are the key properties of 6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine?
6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine has a molecular weight of 292.11 g/mol, XLogP of 3.32, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-(3-fluorophenyl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 59815647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).