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

C14H11BrN2O2 — CID 117250766

IUPAC1-bromo-3-(2-methoxyphenyl)imidazo[1,5-a]pyridin-5-ol
SMILESCOc1ccccc1-c1nc(Br)c2cccc(O)n12
InChIInChI=1S/C14H11BrN2O2/c1-19-11-7-3-2-5-9(11)14-16-13(15)10-6-4-8-12(18)17(10)14/h2-8,18H,1H3
InChIKeyVQWLKXUVCSQZBX-UHFFFAOYSA-N
MW319.16 g/mol
LogP3.48
Rot. Bonds2

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

1-bromo-3-(2-methoxyphenyl)imidazo[1,5-a]pyridin-5-ol (PubChem CID 117250766) has the molecular formula C14H11BrN2O2 and a molecular weight of 319.16 g/mol. Its IUPAC name is 1-bromo-3-(2-methoxyphenyl)imidazo[1,5-a]pyridin-5-ol.

Molecular Properties

Compound Name1-bromo-3-(2-methoxyphenyl)imidazo[1,5-a]pyridin-5-ol
PubChem CID117250766
Molecular FormulaC14H11BrN2O2
Molecular Weight319.16 g/mol
Exact Mass318.00
IUPAC Name1-bromo-3-(2-methoxyphenyl)imidazo[1,5-a]pyridin-5-ol
SMILESCOc1ccccc1-c1nc(Br)c2cccc(O)n12
InChIInChI=1S/C14H11BrN2O2/c1-19-11-7-3-2-5-9(11)14-16-13(15)10-6-4-8-12(18)17(10)14/h2-8,18H,1H3
InChIKeyVQWLKXUVCSQZBX-UHFFFAOYSA-N
XLogP3.48
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.16
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-3-(2-methoxyphenyl)imidazo[1,5-a]pyridin-5-ol?
The IUPAC name of 1-bromo-3-(2-methoxyphenyl)imidazo[1,5-a]pyridin-5-ol (CID 117250766) is 1-bromo-3-(2-methoxyphenyl)imidazo[1,5-a]pyridin-5-ol.
What is the SMILES notation for 1-bromo-3-(2-methoxyphenyl)imidazo[1,5-a]pyridin-5-ol?
The canonical SMILES for 1-bromo-3-(2-methoxyphenyl)imidazo[1,5-a]pyridin-5-ol is COc1ccccc1-c1nc(Br)c2cccc(O)n12.
What is the InChIKey of 1-bromo-3-(2-methoxyphenyl)imidazo[1,5-a]pyridin-5-ol?
The InChIKey is VQWLKXUVCSQZBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrN2O2/c1-19-11-7-3-2-5-9(11)14-16-13(15)10-6-4-8-12(18)17(10)14/h2-8,18H,1H3.
What are the key properties of 1-bromo-3-(2-methoxyphenyl)imidazo[1,5-a]pyridin-5-ol?
1-bromo-3-(2-methoxyphenyl)imidazo[1,5-a]pyridin-5-ol has a molecular weight of 319.16 g/mol, XLogP of 3.48, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-3-(2-methoxyphenyl)imidazo[1,5-a]pyridin-5-ol is sourced from PubChem (CID 117250766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).