About N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide
N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide (PubChem CID 42571061) has the molecular formula C23H17NO4
and a molecular weight of 371.39 g/mol. Its IUPAC name is N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide.
Molecular Properties
| Compound Name | N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide |
| PubChem CID | 42571061 |
| Molecular Formula | C23H17NO4 |
| Molecular Weight | 371.39 g/mol |
| Exact Mass | 371.12 |
| IUPAC Name | N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide |
| SMILES | COc1ccccc1C(=O)Nc1ccc(C(=O)c2cc3ccccc3o2)cc1 |
| InChI | InChI=1S/C23H17NO4/c1-27-20-9-5-3-7-18(20)23(26)24-17-12-10-15(11-13-17)22(25)21-14-16-6-2-4-8-19(16)28-21/h2-14H,1H3,(H,24,26) |
| InChIKey | XRINXVLCSTZHCL-UHFFFAOYSA-N |
| XLogP | 4.92 |
| TPSA | 68.54 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 28 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 371.39 |
| LogP ≤ 5 | 4.92 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide?
The IUPAC name of N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide (CID 42571061) is N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide.
What is the SMILES notation for N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide?
The canonical SMILES for N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide is COc1ccccc1C(=O)Nc1ccc(C(=O)c2cc3ccccc3o2)cc1.
What is the InChIKey of N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide?
The InChIKey is XRINXVLCSTZHCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17NO4/c1-27-20-9-5-3-7-18(20)23(26)24-17-12-10-15(11-13-17)22(25)21-14-16-6-2-4-8-19(16)28-21/h2-14H,1H3,(H,24,26).
What are the key properties of N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide?
N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide has a molecular weight of 371.39 g/mol, XLogP of 4.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1-benzofuran-2-carbonyl)phenyl]-2-methoxybenzamide is sourced from PubChem (CID 42571061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).