About N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide
N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide (PubChem CID 65432090) has the molecular formula C14H11BrFNO2
and a molecular weight of 324.15 g/mol. Its IUPAC name is N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide.
Molecular Properties
| Compound Name | N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide |
| PubChem CID | 65432090 |
| Molecular Formula | C14H11BrFNO2 |
| Molecular Weight | 324.15 g/mol |
| Exact Mass | 323.00 |
| IUPAC Name | N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide |
| SMILES | COc1cccc(F)c1C(=O)Nc1ccccc1Br |
| InChI | InChI=1S/C14H11BrFNO2/c1-19-12-8-4-6-10(16)13(12)14(18)17-11-7-3-2-5-9(11)15/h2-8H,1H3,(H,17,18) |
| InChIKey | IQSMTGAOYMYHIW-UHFFFAOYSA-N |
| XLogP | 3.85 |
| TPSA | 38.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 324.15 |
| LogP ≤ 5 | 3.85 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide?
The IUPAC name of N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide (CID 65432090) is N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide.
What is the SMILES notation for N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide?
The canonical SMILES for N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide is COc1cccc(F)c1C(=O)Nc1ccccc1Br.
What is the InChIKey of N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide?
The InChIKey is IQSMTGAOYMYHIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrFNO2/c1-19-12-8-4-6-10(16)13(12)14(18)17-11-7-3-2-5-9(11)15/h2-8H,1H3,(H,17,18).
What are the key properties of N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide?
N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide has a molecular weight of 324.15 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide is sourced from PubChem (CID 65432090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).