About N-[4-(4-aminophenyl)phenyl]acetamide
N-[4-(4-aminophenyl)phenyl]acetamide (PubChem CID 18787) has the molecular formula C14H14N2O
and a molecular weight of 226.28 g/mol. Its IUPAC name is N-[4-(4-aminophenyl)phenyl]acetamide.
Molecular Properties
| Compound Name | N-[4-(4-aminophenyl)phenyl]acetamide |
| PubChem CID | 18787 |
| Molecular Formula | C14H14N2O |
| Molecular Weight | 226.28 g/mol |
| Exact Mass | 226.11 |
| IUPAC Name | N-[4-(4-aminophenyl)phenyl]acetamide |
| SMILES | CC(=O)Nc1ccc(-c2ccc(N)cc2)cc1 |
| InChI | InChI=1S/C14H14N2O/c1-10(17)16-14-8-4-12(5-9-14)11-2-6-13(15)7-3-11/h2-9H,15H2,1H3,(H,16,17) |
| InChIKey | DZQXBXZZSKPMDV-UHFFFAOYSA-N |
| XLogP | 2.89 |
| TPSA | 55.12 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 226.28 |
| LogP ≤ 5 | 2.89 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aniline', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-[4-(4-aminophenyl)phenyl]acetamide?
The IUPAC name of N-[4-(4-aminophenyl)phenyl]acetamide (CID 18787) is N-[4-(4-aminophenyl)phenyl]acetamide.
What is the SMILES notation for N-[4-(4-aminophenyl)phenyl]acetamide?
The canonical SMILES for N-[4-(4-aminophenyl)phenyl]acetamide is CC(=O)Nc1ccc(-c2ccc(N)cc2)cc1.
What is the InChIKey of N-[4-(4-aminophenyl)phenyl]acetamide?
The InChIKey is DZQXBXZZSKPMDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O/c1-10(17)16-14-8-4-12(5-9-14)11-2-6-13(15)7-3-11/h2-9H,15H2,1H3,(H,16,17).
What are the key properties of N-[4-(4-aminophenyl)phenyl]acetamide?
N-[4-(4-aminophenyl)phenyl]acetamide has a molecular weight of 226.28 g/mol, XLogP of 2.89, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-aminophenyl)phenyl]acetamide is sourced from PubChem (CID 18787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).