1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid

C15H11ClN2O3 — CID 117252470

IUPAC1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid
SMILESCOc1cccc(-c2nc(Cl)c3c(C(=O)O)cccn23)c1
InChIInChI=1S/C15H11ClN2O3/c1-21-10-5-2-4-9(8-10)14-17-13(16)12-11(15(19)20)6-3-7-18(12)14/h2-8H,1H3,(H,19,20)
InChIKeyZUKSOZZOPYZWEL-UHFFFAOYSA-N
MW302.72 g/mol
LogP3.36
Rot. Bonds3

About 1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid

1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid (PubChem CID 117252470) has the molecular formula C15H11ClN2O3 and a molecular weight of 302.72 g/mol. Its IUPAC name is 1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid.

Molecular Properties

Compound Name1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid
PubChem CID117252470
Molecular FormulaC15H11ClN2O3
Molecular Weight302.72 g/mol
Exact Mass302.05
IUPAC Name1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid
SMILESCOc1cccc(-c2nc(Cl)c3c(C(=O)O)cccn23)c1
InChIInChI=1S/C15H11ClN2O3/c1-21-10-5-2-4-9(8-10)14-17-13(16)12-11(15(19)20)6-3-7-18(12)14/h2-8H,1H3,(H,19,20)
InChIKeyZUKSOZZOPYZWEL-UHFFFAOYSA-N
XLogP3.36
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.72
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-7-carboxylic acid
CID 117251877
3-(4-methoxyphenyl)imidazo[1,5-a]pyridine-1,8-dicarboxylic acid
CID 117252602
1-bromo-3-(3-methylphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid
CID 84609069
3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid
CID 117252473
5-chloro-2-(3-methoxyphenyl)benzoic acid
CID 39232676
2-[[2-(3-methoxyphenyl)imidazol-1-yl]methyl]benzoic acid
CID 82560569
1-(4-chlorophenyl)-2-(3-methoxyphenyl)imidazole-4-carboxylic acid
CID 82212317
3-methoxy-2-(3-methoxyphenyl)benzoic acid
CID 19594928
2-chloro-3-(3-methoxyphenyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 67201173
3-chloro-5-(3-methoxyphenyl)benzoic acid
CID 53225426
6-(3-methoxyphenyl)-3-(4-methylphenyl)-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
CID 22548804
2-hydroxy-5-(3-methoxyphenyl)benzoic acid
CID 4564140

Frequently Asked Questions

What is the IUPAC name of 1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid?
The IUPAC name of 1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid (CID 117252470) is 1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid.
What is the SMILES notation for 1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid?
The canonical SMILES for 1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid is COc1cccc(-c2nc(Cl)c3c(C(=O)O)cccn23)c1.
What is the InChIKey of 1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid?
The InChIKey is ZUKSOZZOPYZWEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O3/c1-21-10-5-2-4-9(8-10)14-17-13(16)12-11(15(19)20)6-3-7-18(12)14/h2-8H,1H3,(H,19,20).
What are the key properties of 1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid?
1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid has a molecular weight of 302.72 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-8-carboxylic acid is sourced from PubChem (CID 117252470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).