About 3-[butyl(methyl)amino]-N-propylpropanamide
3-[butyl(methyl)amino]-N-propylpropanamide (PubChem CID 108795247) has the molecular formula C11H24N2O
and a molecular weight of 200.33 g/mol. Its IUPAC name is 3-[butyl(methyl)amino]-N-propylpropanamide.
Molecular Properties
| Compound Name | 3-[butyl(methyl)amino]-N-propylpropanamide |
| PubChem CID | 108795247 |
| Molecular Formula | C11H24N2O |
| Molecular Weight | 200.33 g/mol |
| Exact Mass | 200.19 |
| IUPAC Name | 3-[butyl(methyl)amino]-N-propylpropanamide |
| SMILES | CCCCN(C)CCC(=O)NCCC |
| InChI | InChI=1S/C11H24N2O/c1-4-6-9-13(3)10-7-11(14)12-8-5-2/h4-10H2,1-3H3,(H,12,14) |
| InChIKey | CDUWVABGXPFRHY-UHFFFAOYSA-N |
| XLogP | 1.63 |
| TPSA | 32.34 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 200.33 |
| LogP ≤ 5 | 1.63 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-[butyl(methyl)amino]-N-propylpropanamide?
The IUPAC name of 3-[butyl(methyl)amino]-N-propylpropanamide (CID 108795247) is 3-[butyl(methyl)amino]-N-propylpropanamide.
What is the SMILES notation for 3-[butyl(methyl)amino]-N-propylpropanamide?
The canonical SMILES for 3-[butyl(methyl)amino]-N-propylpropanamide is CCCCN(C)CCC(=O)NCCC.
What is the InChIKey of 3-[butyl(methyl)amino]-N-propylpropanamide?
The InChIKey is CDUWVABGXPFRHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-4-6-9-13(3)10-7-11(14)12-8-5-2/h4-10H2,1-3H3,(H,12,14).
What are the key properties of 3-[butyl(methyl)amino]-N-propylpropanamide?
3-[butyl(methyl)amino]-N-propylpropanamide has a molecular weight of 200.33 g/mol, XLogP of 1.63, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[butyl(methyl)amino]-N-propylpropanamide is sourced from PubChem (CID 108795247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).