About (4-acetamidophenyl) N-phenylcarbamate
(4-acetamidophenyl) N-phenylcarbamate (PubChem CID 58706000) has the molecular formula C15H14N2O3
and a molecular weight of 270.29 g/mol. Its IUPAC name is (4-acetamidophenyl) N-phenylcarbamate.
Molecular Properties
| Compound Name | (4-acetamidophenyl) N-phenylcarbamate |
| PubChem CID | 58706000 |
| Molecular Formula | C15H14N2O3 |
| Molecular Weight | 270.29 g/mol |
| Exact Mass | 270.10 |
| IUPAC Name | (4-acetamidophenyl) N-phenylcarbamate |
| SMILES | CC(=O)Nc1ccc(OC(=O)Nc2ccccc2)cc1 |
| InChI | InChI=1S/C15H14N2O3/c1-11(18)16-13-7-9-14(10-8-13)20-15(19)17-12-5-3-2-4-6-12/h2-10H,1H3,(H,16,18)(H,17,19) |
| InChIKey | KCASPPXERYFZQK-UHFFFAOYSA-N |
| XLogP | 3.26 |
| TPSA | 67.43 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 270.29 |
| LogP ≤ 5 | 3.26 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of (4-acetamidophenyl) N-phenylcarbamate?
The IUPAC name of (4-acetamidophenyl) N-phenylcarbamate (CID 58706000) is (4-acetamidophenyl) N-phenylcarbamate.
What is the SMILES notation for (4-acetamidophenyl) N-phenylcarbamate?
The canonical SMILES for (4-acetamidophenyl) N-phenylcarbamate is CC(=O)Nc1ccc(OC(=O)Nc2ccccc2)cc1.
What is the InChIKey of (4-acetamidophenyl) N-phenylcarbamate?
The InChIKey is KCASPPXERYFZQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-11(18)16-13-7-9-14(10-8-13)20-15(19)17-12-5-3-2-4-6-12/h2-10H,1H3,(H,16,18)(H,17,19).
What are the key properties of (4-acetamidophenyl) N-phenylcarbamate?
(4-acetamidophenyl) N-phenylcarbamate has a molecular weight of 270.29 g/mol, XLogP of 3.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-acetamidophenyl) N-phenylcarbamate is sourced from PubChem (CID 58706000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).