About N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide
N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide (PubChem CID 63143850) has the molecular formula C12H22N2O2
and a molecular weight of 226.32 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide.
Molecular Properties
| Compound Name | N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide |
| PubChem CID | 63143850 |
| Molecular Formula | C12H22N2O2 |
| Molecular Weight | 226.32 g/mol |
| Exact Mass | 226.17 |
| IUPAC Name | N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide |
| SMILES | COCCN(C(=O)C1(C)CCNC1)C1CC1 |
| InChI | InChI=1S/C12H22N2O2/c1-12(5-6-13-9-12)11(15)14(7-8-16-2)10-3-4-10/h10,13H,3-9H2,1-2H3 |
| InChIKey | CHGJFUNJLHWUNE-UHFFFAOYSA-N |
| XLogP | 0.62 |
| TPSA | 41.57 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 226.32 |
| LogP ≤ 5 | 0.62 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide (CID 63143850) is N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide is COCCN(C(=O)C1(C)CCNC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide?
The InChIKey is CHGJFUNJLHWUNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-12(5-6-13-9-12)11(15)14(7-8-16-2)10-3-4-10/h10,13H,3-9H2,1-2H3.
What are the key properties of N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide?
N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 0.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63143850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).