1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol

C11H11BrN2O — CID 117250882

IUPAC1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol
SMILESOc1cccc2c(Br)nc(C3CCC3)n12
InChIInChI=1S/C11H11BrN2O/c12-10-8-5-2-6-9(15)14(8)11(13-10)7-3-1-4-7/h2,5-7,15H,1,3-4H2
InChIKeyVGKBZDDSLFXWQJ-UHFFFAOYSA-N
MW267.13 g/mol
LogP3.07
Rot. Bonds1

About 1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol

1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol (PubChem CID 117250882) has the molecular formula C11H11BrN2O and a molecular weight of 267.13 g/mol. Its IUPAC name is 1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol.

Molecular Properties

Compound Name1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol
PubChem CID117250882
Molecular FormulaC11H11BrN2O
Molecular Weight267.13 g/mol
Exact Mass266.01
IUPAC Name1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol
SMILESOc1cccc2c(Br)nc(C3CCC3)n12
InChIInChI=1S/C11H11BrN2O/c12-10-8-5-2-6-9(15)14(8)11(13-10)7-3-1-4-7/h2,5-7,15H,1,3-4H2
InChIKeyVGKBZDDSLFXWQJ-UHFFFAOYSA-N
XLogP3.07
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.13
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol?
The IUPAC name of 1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol (CID 117250882) is 1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol.
What is the SMILES notation for 1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol?
The canonical SMILES for 1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol is Oc1cccc2c(Br)nc(C3CCC3)n12.
What is the InChIKey of 1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol?
The InChIKey is VGKBZDDSLFXWQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2O/c12-10-8-5-2-6-9(15)14(8)11(13-10)7-3-1-4-7/h2,5-7,15H,1,3-4H2.
What are the key properties of 1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol?
1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol has a molecular weight of 267.13 g/mol, XLogP of 3.07, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-cyclobutylimidazo[1,5-a]pyridin-5-ol is sourced from PubChem (CID 117250882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).