About 2-fluoro-N-(3-methoxyphenyl)benzamide
2-fluoro-N-(3-methoxyphenyl)benzamide (PubChem CID 2292975) has the molecular formula C14H12FNO2
and a molecular weight of 245.25 g/mol. Its IUPAC name is 2-fluoro-N-(3-methoxyphenyl)benzamide.
Molecular Properties
| Compound Name | 2-fluoro-N-(3-methoxyphenyl)benzamide |
| PubChem CID | 2292975 |
| Molecular Formula | C14H12FNO2 |
| Molecular Weight | 245.25 g/mol |
| Exact Mass | 245.09 |
| IUPAC Name | 2-fluoro-N-(3-methoxyphenyl)benzamide |
| SMILES | COc1cccc(NC(=O)c2ccccc2F)c1 |
| InChI | InChI=1S/C14H12FNO2/c1-18-11-6-4-5-10(9-11)16-14(17)12-7-2-3-8-13(12)15/h2-9H,1H3,(H,16,17) |
| InChIKey | YMPCJHXUEDAZST-UHFFFAOYSA-N |
| XLogP | 3.09 |
| TPSA | 38.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 245.25 |
| LogP ≤ 5 | 3.09 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-fluoro-N-(3-methoxyphenyl)benzamide?
The IUPAC name of 2-fluoro-N-(3-methoxyphenyl)benzamide (CID 2292975) is 2-fluoro-N-(3-methoxyphenyl)benzamide.
What is the SMILES notation for 2-fluoro-N-(3-methoxyphenyl)benzamide?
The canonical SMILES for 2-fluoro-N-(3-methoxyphenyl)benzamide is COc1cccc(NC(=O)c2ccccc2F)c1.
What is the InChIKey of 2-fluoro-N-(3-methoxyphenyl)benzamide?
The InChIKey is YMPCJHXUEDAZST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO2/c1-18-11-6-4-5-10(9-11)16-14(17)12-7-2-3-8-13(12)15/h2-9H,1H3,(H,16,17).
What are the key properties of 2-fluoro-N-(3-methoxyphenyl)benzamide?
2-fluoro-N-(3-methoxyphenyl)benzamide has a molecular weight of 245.25 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(3-methoxyphenyl)benzamide is sourced from PubChem (CID 2292975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).