1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol

C13H8BrFN2O — CID 117250826

IUPAC1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol
SMILESOc1cccc2c(Br)nc(-c3ccc(F)cc3)n12
InChIInChI=1S/C13H8BrFN2O/c14-12-10-2-1-3-11(18)17(10)13(16-12)8-4-6-9(15)7-5-8/h1-7,18H
InChIKeyBIHSKFQSKAKWNQ-UHFFFAOYSA-N
MW307.12 g/mol
LogP3.61
Rot. Bonds1

About 1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol

1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol (PubChem CID 117250826) has the molecular formula C13H8BrFN2O and a molecular weight of 307.12 g/mol. Its IUPAC name is 1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol.

Molecular Properties

Compound Name1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol
PubChem CID117250826
Molecular FormulaC13H8BrFN2O
Molecular Weight307.12 g/mol
Exact Mass305.98
IUPAC Name1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol
SMILESOc1cccc2c(Br)nc(-c3ccc(F)cc3)n12
InChIInChI=1S/C13H8BrFN2O/c14-12-10-2-1-3-11(18)17(10)13(16-12)8-4-6-9(15)7-5-8/h1-7,18H
InChIKeyBIHSKFQSKAKWNQ-UHFFFAOYSA-N
XLogP3.61
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.12
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol?
The IUPAC name of 1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol (CID 117250826) is 1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol.
What is the SMILES notation for 1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol?
The canonical SMILES for 1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol is Oc1cccc2c(Br)nc(-c3ccc(F)cc3)n12.
What is the InChIKey of 1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol?
The InChIKey is BIHSKFQSKAKWNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrFN2O/c14-12-10-2-1-3-11(18)17(10)13(16-12)8-4-6-9(15)7-5-8/h1-7,18H.
What are the key properties of 1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol?
1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol has a molecular weight of 307.12 g/mol, XLogP of 3.61, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-ol is sourced from PubChem (CID 117250826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).