About N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide
N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide (PubChem CID 63142224) has the molecular formula C13H24N2O
and a molecular weight of 224.35 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide.
Molecular Properties
| Compound Name | N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide |
| PubChem CID | 63142224 |
| Molecular Formula | C13H24N2O |
| Molecular Weight | 224.35 g/mol |
| Exact Mass | 224.19 |
| IUPAC Name | N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide |
| SMILES | CCC1(C(=O)N(C)CC2CCC2)CCNC1 |
| InChI | InChI=1S/C13H24N2O/c1-3-13(7-8-14-10-13)12(16)15(2)9-11-5-4-6-11/h11,14H,3-10H2,1-2H3 |
| InChIKey | FZEMLHWUENAUEK-UHFFFAOYSA-N |
| XLogP | 1.63 |
| TPSA | 32.34 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 224.35 |
| 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 N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide (CID 63142224) is N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide is CCC1(C(=O)N(C)CC2CCC2)CCNC1.
What is the InChIKey of N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide?
The InChIKey is FZEMLHWUENAUEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-3-13(7-8-14-10-13)12(16)15(2)9-11-5-4-6-11/h11,14H,3-10H2,1-2H3.
What are the key properties of N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide?
N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide has a molecular weight of 224.35 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63142224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).