About 2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide
2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide (PubChem CID 43210198) has the molecular formula C15H21NO2
and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide.
Molecular Properties
| Compound Name | 2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide |
| PubChem CID | 43210198 |
| Molecular Formula | C15H21NO2 |
| Molecular Weight | 247.34 g/mol |
| Exact Mass | 247.16 |
| IUPAC Name | 2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide |
| SMILES | CN(C(=O)CC1CCCCC1)c1ccc(O)cc1 |
| InChI | InChI=1S/C15H21NO2/c1-16(13-7-9-14(17)10-8-13)15(18)11-12-5-3-2-4-6-12/h7-10,12,17H,2-6,11H2,1H3 |
| InChIKey | YMKWYCFRGSBTJH-UHFFFAOYSA-N |
| XLogP | 3.33 |
| TPSA | 40.54 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 247.34 |
| LogP ≤ 5 | 3.33 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide?
The IUPAC name of 2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide (CID 43210198) is 2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide.
What is the SMILES notation for 2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide?
The canonical SMILES for 2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide is CN(C(=O)CC1CCCCC1)c1ccc(O)cc1.
What is the InChIKey of 2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide?
The InChIKey is YMKWYCFRGSBTJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-16(13-7-9-14(17)10-8-13)15(18)11-12-5-3-2-4-6-12/h7-10,12,17H,2-6,11H2,1H3.
What are the key properties of 2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide?
2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide has a molecular weight of 247.34 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide is sourced from PubChem (CID 43210198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).