About N'-(2-chlorophenyl)-N-cyclohexyloxamide
N'-(2-chlorophenyl)-N-cyclohexyloxamide (PubChem CID 7541659) has the molecular formula C14H17ClN2O2
and a molecular weight of 280.75 g/mol. Its IUPAC name is N'-(2-chlorophenyl)-N-cyclohexyloxamide.
Molecular Properties
| Compound Name | N'-(2-chlorophenyl)-N-cyclohexyloxamide |
| PubChem CID | 7541659 |
| Molecular Formula | C14H17ClN2O2 |
| Molecular Weight | 280.75 g/mol |
| Exact Mass | 280.10 |
| IUPAC Name | N'-(2-chlorophenyl)-N-cyclohexyloxamide |
| SMILES | O=C(Nc1ccccc1Cl)C(=O)NC1CCCCC1 |
| InChI | InChI=1S/C14H17ClN2O2/c15-11-8-4-5-9-12(11)17-14(19)13(18)16-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7H2,(H,16,18)(H,17,19) |
| InChIKey | YXTKFWRVBYQEIK-UHFFFAOYSA-N |
| XLogP | 2.73 |
| TPSA | 58.20 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 280.75 |
| LogP ≤ 5 | 2.73 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'diketo_group', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of N'-(2-chlorophenyl)-N-cyclohexyloxamide?
The IUPAC name of N'-(2-chlorophenyl)-N-cyclohexyloxamide (CID 7541659) is N'-(2-chlorophenyl)-N-cyclohexyloxamide.
What is the SMILES notation for N'-(2-chlorophenyl)-N-cyclohexyloxamide?
The canonical SMILES for N'-(2-chlorophenyl)-N-cyclohexyloxamide is O=C(Nc1ccccc1Cl)C(=O)NC1CCCCC1.
What is the InChIKey of N'-(2-chlorophenyl)-N-cyclohexyloxamide?
The InChIKey is YXTKFWRVBYQEIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2O2/c15-11-8-4-5-9-12(11)17-14(19)13(18)16-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7H2,(H,16,18)(H,17,19).
What are the key properties of N'-(2-chlorophenyl)-N-cyclohexyloxamide?
N'-(2-chlorophenyl)-N-cyclohexyloxamide has a molecular weight of 280.75 g/mol, XLogP of 2.73, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-chlorophenyl)-N-cyclohexyloxamide is sourced from PubChem (CID 7541659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).