About 6-(2-fluorophenyl)-3-phenyl-2-propoxypyridine
6-(2-fluorophenyl)-3-phenyl-2-propoxypyridine (PubChem CID 138757062) has the molecular formula C20H18FNO
and a molecular weight of 307.37 g/mol. Its IUPAC name is 6-(2-fluorophenyl)-3-phenyl-2-propoxypyridine.
Molecular Properties
| Compound Name | 6-(2-fluorophenyl)-3-phenyl-2-propoxypyridine |
| PubChem CID | 138757062 |
| Molecular Formula | C20H18FNO |
| Molecular Weight | 307.37 g/mol |
| Exact Mass | 307.14 |
| IUPAC Name | 6-(2-fluorophenyl)-3-phenyl-2-propoxypyridine |
| SMILES | CCCOc1nc(-c2ccccc2F)ccc1-c1ccccc1 |
| InChI | InChI=1S/C20H18FNO/c1-2-14-23-20-16(15-8-4-3-5-9-15)12-13-19(22-20)17-10-6-7-11-18(17)21/h3-13H,2,14H2,1H3 |
| InChIKey | FKJZESCBAPWPIQ-UHFFFAOYSA-N |
| XLogP | 5.34 |
| TPSA | 22.12 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 307.37 |
| LogP ≤ 5 | 5.34 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 6-(2-fluorophenyl)-3-phenyl-2-propoxypyridine?
The IUPAC name of 6-(2-fluorophenyl)-3-phenyl-2-propoxypyridine (CID 138757062) is 6-(2-fluorophenyl)-3-phenyl-2-propoxypyridine.
What is the SMILES notation for 6-(2-fluorophenyl)-3-phenyl-2-propoxypyridine?
The canonical SMILES for 6-(2-fluorophenyl)-3-phenyl-2-propoxypyridine is CCCOc1nc(-c2ccccc2F)ccc1-c1ccccc1.
What is the InChIKey of 6-(2-fluorophenyl)-3-phenyl-2-propoxypyridine?
The InChIKey is FKJZESCBAPWPIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FNO/c1-2-14-23-20-16(15-8-4-3-5-9-15)12-13-19(22-20)17-10-6-7-11-18(17)21/h3-13H,2,14H2,1H3.
What are the key properties of 6-(2-fluorophenyl)-3-phenyl-2-propoxypyridine?
6-(2-fluorophenyl)-3-phenyl-2-propoxypyridine has a molecular weight of 307.37 g/mol, XLogP of 5.34, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluorophenyl)-3-phenyl-2-propoxypyridine is sourced from PubChem (CID 138757062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).