About 2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide
2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide (PubChem CID 107703585) has the molecular formula C11H24N2O3
and a molecular weight of 232.32 g/mol. Its IUPAC name is 2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide.
Molecular Properties
| Compound Name | 2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide |
| PubChem CID | 107703585 |
| Molecular Formula | C11H24N2O3 |
| Molecular Weight | 232.32 g/mol |
| Exact Mass | 232.18 |
| IUPAC Name | 2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide |
| SMILES | COCCNC(=O)CNCCCCCCO |
| InChI | InChI=1S/C11H24N2O3/c1-16-9-7-13-11(15)10-12-6-4-2-3-5-8-14/h12,14H,2-10H2,1H3,(H,13,15) |
| InChIKey | IOYQILYGXOQMOP-UHFFFAOYSA-N |
| XLogP | -0.11 |
| TPSA | 70.59 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 232.32 |
| LogP ≤ 5 | -0.11 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
|---|
Analyze 2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide (CID 107703585) is 2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide is COCCNC(=O)CNCCCCCCO.
What is the InChIKey of 2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide?
The InChIKey is IOYQILYGXOQMOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3/c1-16-9-7-13-11(15)10-12-6-4-2-3-5-8-14/h12,14H,2-10H2,1H3,(H,13,15).
What are the key properties of 2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide?
2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide has a molecular weight of 232.32 g/mol, XLogP of -0.11, 11 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-hydroxyhexylamino)-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 107703585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).