About 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid
6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid (PubChem CID 136986560) has the molecular formula C14H10N2O3
and a molecular weight of 254.25 g/mol. Its IUPAC name is 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid.
Molecular Properties
| Compound Name | 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid |
| PubChem CID | 136986560 |
| Molecular Formula | C14H10N2O3 |
| Molecular Weight | 254.25 g/mol |
| Exact Mass | 254.07 |
| IUPAC Name | 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid |
| SMILES | O=C(O)c1ccc(-c2cc3c(O)cccc3[nH]2)nc1 |
| InChI | InChI=1S/C14H10N2O3/c17-13-3-1-2-10-9(13)6-12(16-10)11-5-4-8(7-15-11)14(18)19/h1-7,16-17H,(H,18,19) |
| InChIKey | DBPGEOIPVYUPEP-UHFFFAOYSA-N |
| XLogP | 2.63 |
| TPSA | 86.21 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 254.25 |
| LogP ≤ 5 | 2.63 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid?
The IUPAC name of 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid (CID 136986560) is 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid.
What is the SMILES notation for 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid?
The canonical SMILES for 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid is O=C(O)c1ccc(-c2cc3c(O)cccc3[nH]2)nc1.
What is the InChIKey of 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid?
The InChIKey is DBPGEOIPVYUPEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O3/c17-13-3-1-2-10-9(13)6-12(16-10)11-5-4-8(7-15-11)14(18)19/h1-7,16-17H,(H,18,19).
What are the key properties of 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid?
6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid has a molecular weight of 254.25 g/mol, XLogP of 2.63, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-hydroxy-1H-indol-2-yl)pyridine-3-carboxylic acid is sourced from PubChem (CID 136986560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).