About N-(2-amino-2-oxoethyl)-2-(oxolan-2-yl)-N-pyrrolidin-3-ylacetamide
N-(2-amino-2-oxoethyl)-2-(oxolan-2-yl)-N-pyrrolidin-3-ylacetamide (PubChem CID 65157348) has the molecular formula C12H21N3O3
and a molecular weight of 255.32 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-2-(oxolan-2-yl)-N-pyrrolidin-3-ylacetamide.
Molecular Properties
| Compound Name | N-(2-amino-2-oxoethyl)-2-(oxolan-2-yl)-N-pyrrolidin-3-ylacetamide |
| PubChem CID | 65157348 |
| Molecular Formula | C12H21N3O3 |
| Molecular Weight | 255.32 g/mol |
| Exact Mass | 255.16 |
| IUPAC Name | N-(2-amino-2-oxoethyl)-2-(oxolan-2-yl)-N-pyrrolidin-3-ylacetamide |
| SMILES | NC(=O)CN(C(=O)CC1CCCO1)C1CCNC1 |
| InChI | InChI=1S/C12H21N3O3/c13-11(16)8-15(9-3-4-14-7-9)12(17)6-10-2-1-5-18-10/h9-10,14H,1-8H2,(H2,13,16) |
| InChIKey | DPZKLHPQWUSBJY-UHFFFAOYSA-N |
| XLogP | -0.77 |
| TPSA | 84.66 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 255.32 |
| LogP ≤ 5 | -0.77 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-(2-amino-2-oxoethyl)-2-(oxolan-2-yl)-N-pyrrolidin-3-ylacetamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-2-(oxolan-2-yl)-N-pyrrolidin-3-ylacetamide (CID 65157348) is N-(2-amino-2-oxoethyl)-2-(oxolan-2-yl)-N-pyrrolidin-3-ylacetamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-2-(oxolan-2-yl)-N-pyrrolidin-3-ylacetamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-2-(oxolan-2-yl)-N-pyrrolidin-3-ylacetamide is NC(=O)CN(C(=O)CC1CCCO1)C1CCNC1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-2-(oxolan-2-yl)-N-pyrrolidin-3-ylacetamide?
The InChIKey is DPZKLHPQWUSBJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O3/c13-11(16)8-15(9-3-4-14-7-9)12(17)6-10-2-1-5-18-10/h9-10,14H,1-8H2,(H2,13,16).
What are the key properties of N-(2-amino-2-oxoethyl)-2-(oxolan-2-yl)-N-pyrrolidin-3-ylacetamide?
N-(2-amino-2-oxoethyl)-2-(oxolan-2-yl)-N-pyrrolidin-3-ylacetamide has a molecular weight of 255.32 g/mol, XLogP of -0.77, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-2-(oxolan-2-yl)-N-pyrrolidin-3-ylacetamide is sourced from PubChem (CID 65157348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).