About N-(4-hydroxyphenyl)octadecanamide
N-(4-hydroxyphenyl)octadecanamide (PubChem CID 7689) has the molecular formula C24H41NO2
and a molecular weight of 375.60 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)octadecanamide.
Molecular Properties
| Compound Name | N-(4-hydroxyphenyl)octadecanamide |
| PubChem CID | 7689 |
| Molecular Formula | C24H41NO2 |
| Molecular Weight | 375.60 g/mol |
| Exact Mass | 375.31 |
| IUPAC Name | N-(4-hydroxyphenyl)octadecanamide |
| SMILES | CCCCCCCCCCCCCCCCCC(=O)Nc1ccc(O)cc1 |
| InChI | InChI=1S/C24H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(27)25-22-18-20-23(26)21-19-22/h18-21,26H,2-17H2,1H3,(H,25,27) |
| InChIKey | YASWBJXTHOXPGK-UHFFFAOYSA-N |
| XLogP | 7.59 |
| TPSA | 49.33 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 17 |
| Heavy Atoms | 27 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 375.60 |
| LogP ≤ 5 | 7.59 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-(4-hydroxyphenyl)octadecanamide?
The IUPAC name of N-(4-hydroxyphenyl)octadecanamide (CID 7689) is N-(4-hydroxyphenyl)octadecanamide.
What is the SMILES notation for N-(4-hydroxyphenyl)octadecanamide?
The canonical SMILES for N-(4-hydroxyphenyl)octadecanamide is CCCCCCCCCCCCCCCCCC(=O)Nc1ccc(O)cc1.
What is the InChIKey of N-(4-hydroxyphenyl)octadecanamide?
The InChIKey is YASWBJXTHOXPGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(27)25-22-18-20-23(26)21-19-22/h18-21,26H,2-17H2,1H3,(H,25,27).
What are the key properties of N-(4-hydroxyphenyl)octadecanamide?
N-(4-hydroxyphenyl)octadecanamide has a molecular weight of 375.60 g/mol, XLogP of 7.59, 17 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)octadecanamide is sourced from PubChem (CID 7689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).