About 7-methoxy-N-methyl-1-benzofuran-2-carboxamide
7-methoxy-N-methyl-1-benzofuran-2-carboxamide (PubChem CID 53281820) has the molecular formula C11H11NO3
and a molecular weight of 205.21 g/mol. Its IUPAC name is 7-methoxy-N-methyl-1-benzofuran-2-carboxamide.
Molecular Properties
| Compound Name | 7-methoxy-N-methyl-1-benzofuran-2-carboxamide |
| PubChem CID | 53281820 |
| Molecular Formula | C11H11NO3 |
| Molecular Weight | 205.21 g/mol |
| Exact Mass | 205.07 |
| IUPAC Name | 7-methoxy-N-methyl-1-benzofuran-2-carboxamide |
| SMILES | CNC(=O)c1cc2cccc(OC)c2o1 |
| InChI | InChI=1S/C11H11NO3/c1-12-11(13)9-6-7-4-3-5-8(14-2)10(7)15-9/h3-6H,1-2H3,(H,12,13) |
| InChIKey | JHHZLLJHFASYDE-UHFFFAOYSA-N |
| XLogP | 1.80 |
| TPSA | 51.47 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 205.21 |
| LogP ≤ 5 | 1.80 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 7-methoxy-N-methyl-1-benzofuran-2-carboxamide?
The IUPAC name of 7-methoxy-N-methyl-1-benzofuran-2-carboxamide (CID 53281820) is 7-methoxy-N-methyl-1-benzofuran-2-carboxamide.
What is the SMILES notation for 7-methoxy-N-methyl-1-benzofuran-2-carboxamide?
The canonical SMILES for 7-methoxy-N-methyl-1-benzofuran-2-carboxamide is CNC(=O)c1cc2cccc(OC)c2o1.
What is the InChIKey of 7-methoxy-N-methyl-1-benzofuran-2-carboxamide?
The InChIKey is JHHZLLJHFASYDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO3/c1-12-11(13)9-6-7-4-3-5-8(14-2)10(7)15-9/h3-6H,1-2H3,(H,12,13).
What are the key properties of 7-methoxy-N-methyl-1-benzofuran-2-carboxamide?
7-methoxy-N-methyl-1-benzofuran-2-carboxamide has a molecular weight of 205.21 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-methyl-1-benzofuran-2-carboxamide is sourced from PubChem (CID 53281820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).