About 5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide
5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide (PubChem CID 99821177) has the molecular formula C15H10F2N4O
and a molecular weight of 300.27 g/mol. Its IUPAC name is 5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide.
Molecular Properties
| Compound Name | 5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide |
| PubChem CID | 99821177 |
| Molecular Formula | C15H10F2N4O |
| Molecular Weight | 300.27 g/mol |
| Exact Mass | 300.08 |
| IUPAC Name | 5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide |
| SMILES | O=C(Nc1cnn(-c2ccccc2F)c1)c1ccc(F)cn1 |
| InChI | InChI=1S/C15H10F2N4O/c16-10-5-6-13(18-7-10)15(22)20-11-8-19-21(9-11)14-4-2-1-3-12(14)17/h1-9H,(H,20,22) |
| InChIKey | LWWNWOYNPMSARF-UHFFFAOYSA-N |
| XLogP | 2.80 |
| TPSA | 59.81 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 300.27 |
| LogP ≤ 5 | 2.80 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide?
The IUPAC name of 5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide (CID 99821177) is 5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide.
What is the SMILES notation for 5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide?
The canonical SMILES for 5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide is O=C(Nc1cnn(-c2ccccc2F)c1)c1ccc(F)cn1.
What is the InChIKey of 5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide?
The InChIKey is LWWNWOYNPMSARF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F2N4O/c16-10-5-6-13(18-7-10)15(22)20-11-8-19-21(9-11)14-4-2-1-3-12(14)17/h1-9H,(H,20,22).
What are the key properties of 5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide?
5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide has a molecular weight of 300.27 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide is sourced from PubChem (CID 99821177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).