About 2-cyclopentyl-N-(4-hydroxy-2-methylbutyl)acetamide
2-cyclopentyl-N-(4-hydroxy-2-methylbutyl)acetamide (PubChem CID 66107291) has the molecular formula C12H23NO2
and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-cyclopentyl-N-(4-hydroxy-2-methylbutyl)acetamide.
Molecular Properties
| Compound Name | 2-cyclopentyl-N-(4-hydroxy-2-methylbutyl)acetamide |
| PubChem CID | 66107291 |
| Molecular Formula | C12H23NO2 |
| Molecular Weight | 213.32 g/mol |
| Exact Mass | 213.17 |
| IUPAC Name | 2-cyclopentyl-N-(4-hydroxy-2-methylbutyl)acetamide |
| SMILES | CC(CCO)CNC(=O)CC1CCCC1 |
| InChI | InChI=1S/C12H23NO2/c1-10(6-7-14)9-13-12(15)8-11-4-2-3-5-11/h10-11,14H,2-9H2,1H3,(H,13,15) |
| InChIKey | MGSLHYDSGSKPPY-UHFFFAOYSA-N |
| XLogP | 1.70 |
| TPSA | 49.33 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 213.32 |
| LogP ≤ 5 | 1.70 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-cyclopentyl-N-(4-hydroxy-2-methylbutyl)acetamide?
The IUPAC name of 2-cyclopentyl-N-(4-hydroxy-2-methylbutyl)acetamide (CID 66107291) is 2-cyclopentyl-N-(4-hydroxy-2-methylbutyl)acetamide.
What is the SMILES notation for 2-cyclopentyl-N-(4-hydroxy-2-methylbutyl)acetamide?
The canonical SMILES for 2-cyclopentyl-N-(4-hydroxy-2-methylbutyl)acetamide is CC(CCO)CNC(=O)CC1CCCC1.
What is the InChIKey of 2-cyclopentyl-N-(4-hydroxy-2-methylbutyl)acetamide?
The InChIKey is MGSLHYDSGSKPPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-10(6-7-14)9-13-12(15)8-11-4-2-3-5-11/h10-11,14H,2-9H2,1H3,(H,13,15).
What are the key properties of 2-cyclopentyl-N-(4-hydroxy-2-methylbutyl)acetamide?
2-cyclopentyl-N-(4-hydroxy-2-methylbutyl)acetamide has a molecular weight of 213.32 g/mol, XLogP of 1.70, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-(4-hydroxy-2-methylbutyl)acetamide is sourced from PubChem (CID 66107291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).