About N-(3-fluoro-4-hydroxyphenyl)acetamide
N-(3-fluoro-4-hydroxyphenyl)acetamide (PubChem CID 3014069) has the molecular formula C8H8FNO2
and a molecular weight of 169.15 g/mol. Its IUPAC name is N-(3-fluoro-4-hydroxyphenyl)acetamide.
Molecular Properties
| Compound Name | N-(3-fluoro-4-hydroxyphenyl)acetamide |
| PubChem CID | 3014069 |
| Molecular Formula | C8H8FNO2 |
| Molecular Weight | 169.15 g/mol |
| Exact Mass | 169.05 |
| IUPAC Name | N-(3-fluoro-4-hydroxyphenyl)acetamide |
| SMILES | CC(=O)Nc1ccc(O)c(F)c1 |
| InChI | InChI=1S/C8H8FNO2/c1-5(11)10-6-2-3-8(12)7(9)4-6/h2-4,12H,1H3,(H,10,11) |
| InChIKey | IUKUSZOKXZUQHT-UHFFFAOYSA-N |
| XLogP | 1.49 |
| TPSA | 49.33 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 169.15 |
| LogP ≤ 5 | 1.49 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydroquinone', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-(3-fluoro-4-hydroxyphenyl)acetamide?
The IUPAC name of N-(3-fluoro-4-hydroxyphenyl)acetamide (CID 3014069) is N-(3-fluoro-4-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(3-fluoro-4-hydroxyphenyl)acetamide?
The canonical SMILES for N-(3-fluoro-4-hydroxyphenyl)acetamide is CC(=O)Nc1ccc(O)c(F)c1.
What is the InChIKey of N-(3-fluoro-4-hydroxyphenyl)acetamide?
The InChIKey is IUKUSZOKXZUQHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FNO2/c1-5(11)10-6-2-3-8(12)7(9)4-6/h2-4,12H,1H3,(H,10,11).
What are the key properties of N-(3-fluoro-4-hydroxyphenyl)acetamide?
N-(3-fluoro-4-hydroxyphenyl)acetamide has a molecular weight of 169.15 g/mol, XLogP of 1.49, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-hydroxyphenyl)acetamide is sourced from PubChem (CID 3014069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).