About N-[4-(2-hydroxyphenoxy)phenyl]formamide
N-[4-(2-hydroxyphenoxy)phenyl]formamide (PubChem CID 87704092) has the molecular formula C13H11NO3
and a molecular weight of 229.24 g/mol. Its IUPAC name is N-[4-(2-hydroxyphenoxy)phenyl]formamide.
Molecular Properties
| Compound Name | N-[4-(2-hydroxyphenoxy)phenyl]formamide |
| PubChem CID | 87704092 |
| Molecular Formula | C13H11NO3 |
| Molecular Weight | 229.24 g/mol |
| Exact Mass | 229.07 |
| IUPAC Name | N-[4-(2-hydroxyphenoxy)phenyl]formamide |
| SMILES | O=CNc1ccc(Oc2ccccc2O)cc1 |
| InChI | InChI=1S/C13H11NO3/c15-9-14-10-5-7-11(8-6-10)17-13-4-2-1-3-12(13)16/h1-9,16H,(H,14,15) |
| InChIKey | LGDHMWCKODZNIP-UHFFFAOYSA-N |
| XLogP | 2.75 |
| TPSA | 58.56 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 229.24 |
| LogP ≤ 5 | 2.75 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aldehyde', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-[4-(2-hydroxyphenoxy)phenyl]formamide?
The IUPAC name of N-[4-(2-hydroxyphenoxy)phenyl]formamide (CID 87704092) is N-[4-(2-hydroxyphenoxy)phenyl]formamide.
What is the SMILES notation for N-[4-(2-hydroxyphenoxy)phenyl]formamide?
The canonical SMILES for N-[4-(2-hydroxyphenoxy)phenyl]formamide is O=CNc1ccc(Oc2ccccc2O)cc1.
What is the InChIKey of N-[4-(2-hydroxyphenoxy)phenyl]formamide?
The InChIKey is LGDHMWCKODZNIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO3/c15-9-14-10-5-7-11(8-6-10)17-13-4-2-1-3-12(13)16/h1-9,16H,(H,14,15).
What are the key properties of N-[4-(2-hydroxyphenoxy)phenyl]formamide?
N-[4-(2-hydroxyphenoxy)phenyl]formamide has a molecular weight of 229.24 g/mol, XLogP of 2.75, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-hydroxyphenoxy)phenyl]formamide is sourced from PubChem (CID 87704092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).