About 4-(2-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole
4-(2-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole (PubChem CID 2347880) has the molecular formula C14H9FN2S
and a molecular weight of 256.31 g/mol. Its IUPAC name is 4-(2-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole.
Molecular Properties
| Compound Name | 4-(2-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole |
| PubChem CID | 2347880 |
| Molecular Formula | C14H9FN2S |
| Molecular Weight | 256.31 g/mol |
| Exact Mass | 256.05 |
| IUPAC Name | 4-(2-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole |
| SMILES | Fc1ccccc1-c1csc(-c2cccnc2)n1 |
| InChI | InChI=1S/C14H9FN2S/c15-12-6-2-1-5-11(12)13-9-18-14(17-13)10-4-3-7-16-8-10/h1-9H |
| InChIKey | QPXHSYPTGNIYEE-UHFFFAOYSA-N |
| XLogP | 4.01 |
| TPSA | 25.78 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 256.31 |
| LogP ≤ 5 | 4.01 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-(2-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole?
The IUPAC name of 4-(2-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole (CID 2347880) is 4-(2-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole.
What is the SMILES notation for 4-(2-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole?
The canonical SMILES for 4-(2-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole is Fc1ccccc1-c1csc(-c2cccnc2)n1.
What is the InChIKey of 4-(2-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole?
The InChIKey is QPXHSYPTGNIYEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9FN2S/c15-12-6-2-1-5-11(12)13-9-18-14(17-13)10-4-3-7-16-8-10/h1-9H.
What are the key properties of 4-(2-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole?
4-(2-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole has a molecular weight of 256.31 g/mol, XLogP of 4.01, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole is sourced from PubChem (CID 2347880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).