About 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid (PubChem CID 137005552) has the molecular formula C15H19N3O3
and a molecular weight of 289.33 g/mol. Its IUPAC name is 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid.
Molecular Properties
| Compound Name | 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid |
| PubChem CID | 137005552 |
| Molecular Formula | C15H19N3O3 |
| Molecular Weight | 289.33 g/mol |
| Exact Mass | 289.14 |
| IUPAC Name | 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid |
| SMILES | CC(C)N1CCC(c2nc(C(=O)O)c3cccc(O)n23)C1 |
| InChI | InChI=1S/C15H19N3O3/c1-9(2)17-7-6-10(8-17)14-16-13(15(20)21)11-4-3-5-12(19)18(11)14/h3-5,9-10,19H,6-8H2,1-2H3,(H,20,21) |
| InChIKey | OBVZFIJTMOIPOV-UHFFFAOYSA-N |
| XLogP | 1.94 |
| TPSA | 78.07 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 289.33 |
| LogP ≤ 5 | 1.94 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The IUPAC name of 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid (CID 137005552) is 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid.
What is the SMILES notation for 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The canonical SMILES for 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid is CC(C)N1CCC(c2nc(C(=O)O)c3cccc(O)n23)C1.
What is the InChIKey of 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The InChIKey is OBVZFIJTMOIPOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-9(2)17-7-6-10(8-17)14-16-13(15(20)21)11-4-3-5-12(19)18(11)14/h3-5,9-10,19H,6-8H2,1-2H3,(H,20,21).
What are the key properties of 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid?
5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid has a molecular weight of 289.33 g/mol, XLogP of 1.94, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid is sourced from PubChem (CID 137005552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).