About N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide
N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide (PubChem CID 62648777) has the molecular formula C11H15FN2O
and a molecular weight of 210.25 g/mol. Its IUPAC name is N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide.
Molecular Properties
| Compound Name | N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide |
| PubChem CID | 62648777 |
| Molecular Formula | C11H15FN2O |
| Molecular Weight | 210.25 g/mol |
| Exact Mass | 210.12 |
| IUPAC Name | N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide |
| SMILES | CCN(C)C(=O)c1cccc(F)c1NC |
| InChI | InChI=1S/C11H15FN2O/c1-4-14(3)11(15)8-6-5-7-9(12)10(8)13-2/h5-7,13H,4H2,1-3H3 |
| InChIKey | OEZDTALXIVJSHK-UHFFFAOYSA-N |
| XLogP | 1.96 |
| TPSA | 32.34 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 210.25 |
| LogP ≤ 5 | 1.96 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide?
The IUPAC name of N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide (CID 62648777) is N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide.
What is the SMILES notation for N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide?
The canonical SMILES for N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide is CCN(C)C(=O)c1cccc(F)c1NC.
What is the InChIKey of N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide?
The InChIKey is OEZDTALXIVJSHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O/c1-4-14(3)11(15)8-6-5-7-9(12)10(8)13-2/h5-7,13H,4H2,1-3H3.
What are the key properties of N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide?
N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide has a molecular weight of 210.25 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-fluoro-N-methyl-2-(methylamino)benzamide is sourced from PubChem (CID 62648777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).