About 6-chloro-2-(4-fluoro-1H-indol-2-yl)-5-methylpyridin-3-ol
6-chloro-2-(4-fluoro-1H-indol-2-yl)-5-methylpyridin-3-ol (PubChem CID 123153518) has the molecular formula C14H10ClFN2O
and a molecular weight of 276.70 g/mol. Its IUPAC name is 6-chloro-2-(4-fluoro-1H-indol-2-yl)-5-methylpyridin-3-ol.
Molecular Properties
| Compound Name | 6-chloro-2-(4-fluoro-1H-indol-2-yl)-5-methylpyridin-3-ol |
| PubChem CID | 123153518 |
| Molecular Formula | C14H10ClFN2O |
| Molecular Weight | 276.70 g/mol |
| Exact Mass | 276.05 |
| IUPAC Name | 6-chloro-2-(4-fluoro-1H-indol-2-yl)-5-methylpyridin-3-ol |
| SMILES | Cc1cc(O)c(-c2cc3c(F)cccc3[nH]2)nc1Cl |
| InChI | InChI=1S/C14H10ClFN2O/c1-7-5-12(19)13(18-14(7)15)11-6-8-9(16)3-2-4-10(8)17-11/h2-6,17,19H,1H3 |
| InChIKey | VASDXAVLSQXTNH-UHFFFAOYSA-N |
| XLogP | 4.04 |
| TPSA | 48.91 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 276.70 |
| LogP ≤ 5 | 4.04 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 6-chloro-2-(4-fluoro-1H-indol-2-yl)-5-methylpyridin-3-ol?
The IUPAC name of 6-chloro-2-(4-fluoro-1H-indol-2-yl)-5-methylpyridin-3-ol (CID 123153518) is 6-chloro-2-(4-fluoro-1H-indol-2-yl)-5-methylpyridin-3-ol.
What is the SMILES notation for 6-chloro-2-(4-fluoro-1H-indol-2-yl)-5-methylpyridin-3-ol?
The canonical SMILES for 6-chloro-2-(4-fluoro-1H-indol-2-yl)-5-methylpyridin-3-ol is Cc1cc(O)c(-c2cc3c(F)cccc3[nH]2)nc1Cl.
What is the InChIKey of 6-chloro-2-(4-fluoro-1H-indol-2-yl)-5-methylpyridin-3-ol?
The InChIKey is VASDXAVLSQXTNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClFN2O/c1-7-5-12(19)13(18-14(7)15)11-6-8-9(16)3-2-4-10(8)17-11/h2-6,17,19H,1H3.
What are the key properties of 6-chloro-2-(4-fluoro-1H-indol-2-yl)-5-methylpyridin-3-ol?
6-chloro-2-(4-fluoro-1H-indol-2-yl)-5-methylpyridin-3-ol has a molecular weight of 276.70 g/mol, XLogP of 4.04, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(4-fluoro-1H-indol-2-yl)-5-methylpyridin-3-ol is sourced from PubChem (CID 123153518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).