1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol

C13H9BrN2O2 — CID 137005641

IUPAC1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol
SMILESOc1ccc2c(Br)nc(-c3ccccc3O)n2c1
InChIInChI=1S/C13H9BrN2O2/c14-12-10-6-5-8(17)7-16(10)13(15-12)9-3-1-2-4-11(9)18/h1-7,17-18H
InChIKeyHFRQZOOKIGHDBM-UHFFFAOYSA-N
MW305.13 g/mol
LogP3.17
Rot. Bonds1

About 1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol

1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol (PubChem CID 137005641) has the molecular formula C13H9BrN2O2 and a molecular weight of 305.13 g/mol. Its IUPAC name is 1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol.

Molecular Properties

Compound Name1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol
PubChem CID137005641
Molecular FormulaC13H9BrN2O2
Molecular Weight305.13 g/mol
Exact Mass303.98
IUPAC Name1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol
SMILESOc1ccc2c(Br)nc(-c3ccccc3O)n2c1
InChIInChI=1S/C13H9BrN2O2/c14-12-10-6-5-8(17)7-16(10)13(15-12)9-3-1-2-4-11(9)18/h1-7,17-18H
InChIKeyHFRQZOOKIGHDBM-UHFFFAOYSA-N
XLogP3.17
TPSA57.76 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.13
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol?
The IUPAC name of 1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol (CID 137005641) is 1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol.
What is the SMILES notation for 1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol?
The canonical SMILES for 1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol is Oc1ccc2c(Br)nc(-c3ccccc3O)n2c1.
What is the InChIKey of 1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol?
The InChIKey is HFRQZOOKIGHDBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9BrN2O2/c14-12-10-6-5-8(17)7-16(10)13(15-12)9-3-1-2-4-11(9)18/h1-7,17-18H.
What are the key properties of 1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol?
1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol has a molecular weight of 305.13 g/mol, XLogP of 3.17, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-(2-hydroxyphenyl)imidazo[1,5-a]pyridin-6-ol is sourced from PubChem (CID 137005641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).