1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid

C15H10N2O3 — CID 84742895

IUPAC1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid
SMILESO=Cc1nc(-c2ccccc2)n2ccc(C(=O)O)cc12
InChIInChI=1S/C15H10N2O3/c18-9-12-13-8-11(15(19)20)6-7-17(13)14(16-12)10-4-2-1-3-5-10/h1-9H,(H,19,20)
InChIKeyNMFQJLQZHMCVCB-UHFFFAOYSA-N
MW266.26 g/mol
LogP2.51
Rot. Bonds3

About 1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid

1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid (PubChem CID 84742895) has the molecular formula C15H10N2O3 and a molecular weight of 266.26 g/mol. Its IUPAC name is 1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid.

Molecular Properties

Compound Name1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid
PubChem CID84742895
Molecular FormulaC15H10N2O3
Molecular Weight266.26 g/mol
Exact Mass266.07
IUPAC Name1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid
SMILESO=Cc1nc(-c2ccccc2)n2ccc(C(=O)O)cc12
InChIInChI=1S/C15H10N2O3/c18-9-12-13-8-11(15(19)20)6-7-17(13)14(16-12)10-4-2-1-3-5-10/h1-9H,(H,19,20)
InChIKeyNMFQJLQZHMCVCB-UHFFFAOYSA-N
XLogP2.51
TPSA71.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid
CID 83870930
3-(aminomethyl)-1-formylimidazo[1,5-a]pyridine-7-carboxylic acid
CID 84740260
1-formyl-3-propan-2-ylimidazo[1,5-a]pyridine-7-carboxylic acid
CID 84740930
1-formyl-3-(2-methylpropyl)imidazo[1,5-a]pyridine-7-carboxylic acid
CID 84741781
3-pyridin-3-ylimidazo[1,5-a]pyridine-1,7-dicarboxylic acid
CID 117251777
1-chloro-3-(4-fluorophenyl)imidazo[1,5-a]pyridine-7-carboxylic acid
CID 117251989
6-chloro-3-phenylimidazo[1,5-a]pyridine-1-carbaldehyde
CID 84742339
7-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84745096
1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-7-carboxylic acid
CID 117251877
7-bromo-3-(4-methoxyphenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84744943
3-hydroxy-2-phenylbenzimidazole-5-carboxylic acid
CID 10083635
3-(4-bromophenyl)-7-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84745253

Frequently Asked Questions

What is the IUPAC name of 1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid?
The IUPAC name of 1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid (CID 84742895) is 1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid.
What is the SMILES notation for 1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid?
The canonical SMILES for 1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid is O=Cc1nc(-c2ccccc2)n2ccc(C(=O)O)cc12.
What is the InChIKey of 1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid?
The InChIKey is NMFQJLQZHMCVCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O3/c18-9-12-13-8-11(15(19)20)6-7-17(13)14(16-12)10-4-2-1-3-5-10/h1-9H,(H,19,20).
What are the key properties of 1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid?
1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid has a molecular weight of 266.26 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid is sourced from PubChem (CID 84742895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).