7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid

C15H11BrN2O2 — CID 84744919

IUPAC7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
SMILESCc1ccc(-c2nc(C(=O)O)c3cc(Br)ccn23)cc1
InChIInChI=1S/C15H11BrN2O2/c1-9-2-4-10(5-3-9)14-17-13(15(19)20)12-8-11(16)6-7-18(12)14/h2-8H,1H3,(H,19,20)
InChIKeyJQVAMPMEJDZHRC-UHFFFAOYSA-N
MW331.17 g/mol
LogP3.77
Rot. Bonds2

About 7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid

7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid (PubChem CID 84744919) has the molecular formula C15H11BrN2O2 and a molecular weight of 331.17 g/mol. Its IUPAC name is 7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid.

Molecular Properties

Compound Name7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
PubChem CID84744919
Molecular FormulaC15H11BrN2O2
Molecular Weight331.17 g/mol
Exact Mass330.00
IUPAC Name7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
SMILESCc1ccc(-c2nc(C(=O)O)c3cc(Br)ccn23)cc1
InChIInChI=1S/C15H11BrN2O2/c1-9-2-4-10(5-3-9)14-17-13(15(19)20)12-8-11(16)6-7-18(12)14/h2-8H,1H3,(H,19,20)
InChIKeyJQVAMPMEJDZHRC-UHFFFAOYSA-N
XLogP3.77
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.17
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-bromo-3-thiophen-2-ylimidazo[1,5-a]pyridine-1-carboxylic acid
CID 84744734
7-bromo-3-[(dimethylamino)methyl]imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117255480
7-methyl-3-(2-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 84742900
1-bromo-7-methyl-3-(4-methylphenyl)imidazo[1,5-a]pyridine
CID 84744102
7-bromo-3-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid
CID 166609430
3-(4-fluorophenyl)-6-methylimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117251462
7-bromo-3-(4-methoxyphenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84744943
3-pyridin-3-ylimidazo[1,5-a]pyridine-1,7-dicarboxylic acid
CID 117251777
3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 28752075
3-tert-butyl-7-methylimidazo[1,5-a]pyridine-1-carboxylic acid
CID 83840855
7-bromo-3-[(cyclopropylamino)methyl]imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117255473
7-hydroxy-3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117251758

Frequently Asked Questions

What is the IUPAC name of 7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The IUPAC name of 7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid (CID 84744919) is 7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid.
What is the SMILES notation for 7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The canonical SMILES for 7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid is Cc1ccc(-c2nc(C(=O)O)c3cc(Br)ccn23)cc1.
What is the InChIKey of 7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The InChIKey is JQVAMPMEJDZHRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrN2O2/c1-9-2-4-10(5-3-9)14-17-13(15(19)20)12-8-11(16)6-7-18(12)14/h2-8H,1H3,(H,19,20).
What are the key properties of 7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid?
7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid has a molecular weight of 331.17 g/mol, XLogP of 3.77, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid is sourced from PubChem (CID 84744919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).