About N-[2-(2-amino-2-oxoethoxy)ethyl]piperidine-1-carboxamide
N-[2-(2-amino-2-oxoethoxy)ethyl]piperidine-1-carboxamide (PubChem CID 103816389) has the molecular formula C10H19N3O3
and a molecular weight of 229.28 g/mol. Its IUPAC name is N-[2-(2-amino-2-oxoethoxy)ethyl]piperidine-1-carboxamide.
Molecular Properties
| Compound Name | N-[2-(2-amino-2-oxoethoxy)ethyl]piperidine-1-carboxamide |
| PubChem CID | 103816389 |
| Molecular Formula | C10H19N3O3 |
| Molecular Weight | 229.28 g/mol |
| Exact Mass | 229.14 |
| IUPAC Name | N-[2-(2-amino-2-oxoethoxy)ethyl]piperidine-1-carboxamide |
| SMILES | NC(=O)COCCNC(=O)N1CCCCC1 |
| InChI | InChI=1S/C10H19N3O3/c11-9(14)8-16-7-4-12-10(15)13-5-2-1-3-6-13/h1-8H2,(H2,11,14)(H,12,15) |
| InChIKey | ZLRXIOKXYVDZPS-UHFFFAOYSA-N |
| XLogP | -0.32 |
| TPSA | 84.66 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 229.28 |
| LogP ≤ 5 | -0.32 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-[2-(2-amino-2-oxoethoxy)ethyl]piperidine-1-carboxamide?
The IUPAC name of N-[2-(2-amino-2-oxoethoxy)ethyl]piperidine-1-carboxamide (CID 103816389) is N-[2-(2-amino-2-oxoethoxy)ethyl]piperidine-1-carboxamide.
What is the SMILES notation for N-[2-(2-amino-2-oxoethoxy)ethyl]piperidine-1-carboxamide?
The canonical SMILES for N-[2-(2-amino-2-oxoethoxy)ethyl]piperidine-1-carboxamide is NC(=O)COCCNC(=O)N1CCCCC1.
What is the InChIKey of N-[2-(2-amino-2-oxoethoxy)ethyl]piperidine-1-carboxamide?
The InChIKey is ZLRXIOKXYVDZPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O3/c11-9(14)8-16-7-4-12-10(15)13-5-2-1-3-6-13/h1-8H2,(H2,11,14)(H,12,15).
What are the key properties of N-[2-(2-amino-2-oxoethoxy)ethyl]piperidine-1-carboxamide?
N-[2-(2-amino-2-oxoethoxy)ethyl]piperidine-1-carboxamide has a molecular weight of 229.28 g/mol, XLogP of -0.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-amino-2-oxoethoxy)ethyl]piperidine-1-carboxamide is sourced from PubChem (CID 103816389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).