About N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide
N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide (PubChem CID 82731736) has the molecular formula C11H23N3O2
and a molecular weight of 229.32 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide.
Molecular Properties
| Compound Name | N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide |
| PubChem CID | 82731736 |
| Molecular Formula | C11H23N3O2 |
| Molecular Weight | 229.32 g/mol |
| Exact Mass | 229.18 |
| IUPAC Name | N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide |
| SMILES | CN(CCCN)C(=O)CN(C)C1CCOC1 |
| InChI | InChI=1S/C11H23N3O2/c1-13(6-3-5-12)11(15)8-14(2)10-4-7-16-9-10/h10H,3-9,12H2,1-2H3 |
| InChIKey | UJQANNIPQTWHBM-UHFFFAOYSA-N |
| XLogP | -0.49 |
| TPSA | 58.80 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 229.32 |
| LogP ≤ 5 | -0.49 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide?
The IUPAC name of N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide (CID 82731736) is N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide.
What is the SMILES notation for N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide?
The canonical SMILES for N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide is CN(CCCN)C(=O)CN(C)C1CCOC1.
What is the InChIKey of N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide?
The InChIKey is UJQANNIPQTWHBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-13(6-3-5-12)11(15)8-14(2)10-4-7-16-9-10/h10H,3-9,12H2,1-2H3.
What are the key properties of N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide?
N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide has a molecular weight of 229.32 g/mol, XLogP of -0.49, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-methyl-2-[methyl(oxolan-3-yl)amino]acetamide is sourced from PubChem (CID 82731736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).