About 5-amino-3-(4-fluorophenyl)-1H-pyridin-2-one
5-amino-3-(4-fluorophenyl)-1H-pyridin-2-one (PubChem CID 82282728) has the molecular formula C11H9FN2O
and a molecular weight of 204.20 g/mol. Its IUPAC name is 5-amino-3-(4-fluorophenyl)-1H-pyridin-2-one.
Molecular Properties
| Compound Name | 5-amino-3-(4-fluorophenyl)-1H-pyridin-2-one |
| PubChem CID | 82282728 |
| Molecular Formula | C11H9FN2O |
| Molecular Weight | 204.20 g/mol |
| Exact Mass | 204.07 |
| IUPAC Name | 5-amino-3-(4-fluorophenyl)-1H-pyridin-2-one |
| SMILES | Nc1c[nH]c(=O)c(-c2ccc(F)cc2)c1 |
| InChI | InChI=1S/C11H9FN2O/c12-8-3-1-7(2-4-8)10-5-9(13)6-14-11(10)15/h1-6H,13H2,(H,14,15) |
| InChIKey | WGKFTKOZZXQIMF-UHFFFAOYSA-N |
| XLogP | 1.76 |
| TPSA | 58.88 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 204.20 |
| LogP ≤ 5 | 1.76 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 5-amino-3-(4-fluorophenyl)-1H-pyridin-2-one?
The IUPAC name of 5-amino-3-(4-fluorophenyl)-1H-pyridin-2-one (CID 82282728) is 5-amino-3-(4-fluorophenyl)-1H-pyridin-2-one.
What is the SMILES notation for 5-amino-3-(4-fluorophenyl)-1H-pyridin-2-one?
The canonical SMILES for 5-amino-3-(4-fluorophenyl)-1H-pyridin-2-one is Nc1c[nH]c(=O)c(-c2ccc(F)cc2)c1.
What is the InChIKey of 5-amino-3-(4-fluorophenyl)-1H-pyridin-2-one?
The InChIKey is WGKFTKOZZXQIMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2O/c12-8-3-1-7(2-4-8)10-5-9(13)6-14-11(10)15/h1-6H,13H2,(H,14,15).
What are the key properties of 5-amino-3-(4-fluorophenyl)-1H-pyridin-2-one?
5-amino-3-(4-fluorophenyl)-1H-pyridin-2-one has a molecular weight of 204.20 g/mol, XLogP of 1.76, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-(4-fluorophenyl)-1H-pyridin-2-one is sourced from PubChem (CID 82282728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).