About 2-[2-methoxyethyl(propyl)amino]-N-[2-(methylamino)ethyl]-N-(2-oxopropyl)acetamide
2-[2-methoxyethyl(propyl)amino]-N-[2-(methylamino)ethyl]-N-(2-oxopropyl)acetamide (PubChem CID 20709827) has the molecular formula C14H29N3O3
and a molecular weight of 287.40 g/mol. Its IUPAC name is 2-[2-methoxyethyl(propyl)amino]-N-[2-(methylamino)ethyl]-N-(2-oxopropyl)acetamide.
Molecular Properties
| Compound Name | 2-[2-methoxyethyl(propyl)amino]-N-[2-(methylamino)ethyl]-N-(2-oxopropyl)acetamide |
| PubChem CID | 20709827 |
| Molecular Formula | C14H29N3O3 |
| Molecular Weight | 287.40 g/mol |
| Exact Mass | 287.22 |
| IUPAC Name | 2-[2-methoxyethyl(propyl)amino]-N-[2-(methylamino)ethyl]-N-(2-oxopropyl)acetamide |
| SMILES | CCCN(CCOC)CC(=O)N(CCNC)CC(C)=O |
| InChI | InChI=1S/C14H29N3O3/c1-5-7-16(9-10-20-4)12-14(19)17(8-6-15-3)11-13(2)18/h15H,5-12H2,1-4H3 |
| InChIKey | WVIXSEBIRYPWEG-UHFFFAOYSA-N |
| XLogP | -0.02 |
| TPSA | 61.88 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 287.40 |
| LogP ≤ 5 | -0.02 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 2-[2-methoxyethyl(propyl)amino]-N-[2-(methylamino)ethyl]-N-(2-oxopropyl)acetamide?
The IUPAC name of 2-[2-methoxyethyl(propyl)amino]-N-[2-(methylamino)ethyl]-N-(2-oxopropyl)acetamide (CID 20709827) is 2-[2-methoxyethyl(propyl)amino]-N-[2-(methylamino)ethyl]-N-(2-oxopropyl)acetamide.
What is the SMILES notation for 2-[2-methoxyethyl(propyl)amino]-N-[2-(methylamino)ethyl]-N-(2-oxopropyl)acetamide?
The canonical SMILES for 2-[2-methoxyethyl(propyl)amino]-N-[2-(methylamino)ethyl]-N-(2-oxopropyl)acetamide is CCCN(CCOC)CC(=O)N(CCNC)CC(C)=O.
What is the InChIKey of 2-[2-methoxyethyl(propyl)amino]-N-[2-(methylamino)ethyl]-N-(2-oxopropyl)acetamide?
The InChIKey is WVIXSEBIRYPWEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O3/c1-5-7-16(9-10-20-4)12-14(19)17(8-6-15-3)11-13(2)18/h15H,5-12H2,1-4H3.
What are the key properties of 2-[2-methoxyethyl(propyl)amino]-N-[2-(methylamino)ethyl]-N-(2-oxopropyl)acetamide?
2-[2-methoxyethyl(propyl)amino]-N-[2-(methylamino)ethyl]-N-(2-oxopropyl)acetamide has a molecular weight of 287.40 g/mol, XLogP of -0.02, 12 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxyethyl(propyl)amino]-N-[2-(methylamino)ethyl]-N-(2-oxopropyl)acetamide is sourced from PubChem (CID 20709827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).