About N-(3-aminopropyl)-N-ethyldecanamide
N-(3-aminopropyl)-N-ethyldecanamide (PubChem CID 65447961) has the molecular formula C15H32N2O
and a molecular weight of 256.43 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-ethyldecanamide.
Molecular Properties
| Compound Name | N-(3-aminopropyl)-N-ethyldecanamide |
| PubChem CID | 65447961 |
| Molecular Formula | C15H32N2O |
| Molecular Weight | 256.43 g/mol |
| Exact Mass | 256.25 |
| IUPAC Name | N-(3-aminopropyl)-N-ethyldecanamide |
| SMILES | CCCCCCCCCC(=O)N(CC)CCCN |
| InChI | InChI=1S/C15H32N2O/c1-3-5-6-7-8-9-10-12-15(18)17(4-2)14-11-13-16/h3-14,16H2,1-2H3 |
| InChIKey | ZZEPMIZJKXQJDL-UHFFFAOYSA-N |
| XLogP | 3.32 |
| TPSA | 46.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 256.43 |
| LogP ≤ 5 | 3.32 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-(3-aminopropyl)-N-ethyldecanamide?
The IUPAC name of N-(3-aminopropyl)-N-ethyldecanamide (CID 65447961) is N-(3-aminopropyl)-N-ethyldecanamide.
What is the SMILES notation for N-(3-aminopropyl)-N-ethyldecanamide?
The canonical SMILES for N-(3-aminopropyl)-N-ethyldecanamide is CCCCCCCCCC(=O)N(CC)CCCN.
What is the InChIKey of N-(3-aminopropyl)-N-ethyldecanamide?
The InChIKey is ZZEPMIZJKXQJDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-3-5-6-7-8-9-10-12-15(18)17(4-2)14-11-13-16/h3-14,16H2,1-2H3.
What are the key properties of N-(3-aminopropyl)-N-ethyldecanamide?
N-(3-aminopropyl)-N-ethyldecanamide has a molecular weight of 256.43 g/mol, XLogP of 3.32, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-ethyldecanamide is sourced from PubChem (CID 65447961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).