3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid

C15H12N2O2 — CID 84737805

IUPAC3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid
SMILESCc1ccc(-c2ncc3ccc(C(=O)O)cn23)cc1
InChIInChI=1S/C15H12N2O2/c1-10-2-4-11(5-3-10)14-16-8-13-7-6-12(15(18)19)9-17(13)14/h2-9H,1H3,(H,18,19)
InChIKeyZOVJJVDGUDTBEM-UHFFFAOYSA-N
MW252.27 g/mol
LogP3.01
Rot. Bonds2

About 3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid

3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid (PubChem CID 84737805) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid
PubChem CID84737805
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid
SMILESCc1ccc(-c2ncc3ccc(C(=O)O)cn23)cc1
InChIInChI=1S/C15H12N2O2/c1-10-2-4-11(5-3-10)14-16-8-13-7-6-12(15(18)19)9-17(13)14/h2-9H,1H3,(H,18,19)
InChIKeyZOVJJVDGUDTBEM-UHFFFAOYSA-N
XLogP3.01
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[3-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine-6-carboxylic acid
CID 117140347
3-[(3-methylphenyl)methyl]imidazo[1,5-a]pyridine-6-carboxylic acid
CID 117140304
1-chloro-3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid
CID 117251411
3-(6-bromoimidazo[1,5-a]pyridin-3-yl)benzoic acid
CID 117158432
4-(7-chloroimidazo[1,5-a]pyridin-3-yl)benzoic acid
CID 117158552
3-cyclobutylimidazo[1,5-a]pyridine-6-carboxylic acid
CID 83835844
3-[2-(4-methylpiperazin-1-yl)ethyl]imidazo[1,5-a]pyridine-6-carboxylic acid
CID 117140371
3-amino-2-(4-methylphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid
CID 82356036
3-(3-cyclohexa-2,4-dien-1-yl-5-methyl-1,2-oxazol-4-yl)imidazo[1,5-a]pyridine-6-carboxylic acid
CID 70313117
alumane;4-methylbenzoic acid
CID 173230362
CID 158355468
CID 158355468
indigane;4-methylbenzoic acid
CID 173230327

Frequently Asked Questions

What is the IUPAC name of 3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid?
The IUPAC name of 3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid (CID 84737805) is 3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid.
What is the SMILES notation for 3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid?
The canonical SMILES for 3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid is Cc1ccc(-c2ncc3ccc(C(=O)O)cn23)cc1.
What is the InChIKey of 3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid?
The InChIKey is ZOVJJVDGUDTBEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-10-2-4-11(5-3-10)14-16-8-13-7-6-12(15(18)19)9-17(13)14/h2-9H,1H3,(H,18,19).
What are the key properties of 3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid?
3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid has a molecular weight of 252.27 g/mol, XLogP of 3.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid is sourced from PubChem (CID 84737805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).