About 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid
4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid (PubChem CID 123694815) has the molecular formula C12H20N2O5
and a molecular weight of 272.30 g/mol. Its IUPAC name is 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid.
Molecular Properties
| Compound Name | 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid |
| PubChem CID | 123694815 |
| Molecular Formula | C12H20N2O5 |
| Molecular Weight | 272.30 g/mol |
| Exact Mass | 272.14 |
| IUPAC Name | 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid |
| SMILES | O=C(O)N1CCC(OCC(=O)N2CCOCC2)CC1 |
| InChI | InChI=1S/C12H20N2O5/c15-11(13-5-7-18-8-6-13)9-19-10-1-3-14(4-2-10)12(16)17/h10H,1-9H2,(H,16,17) |
| InChIKey | ZQIKIZSXZZPVDZ-UHFFFAOYSA-N |
| XLogP | 0.00 |
| TPSA | 79.31 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 272.30 |
| LogP ≤ 5 | 0.00 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid?
The IUPAC name of 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid (CID 123694815) is 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid.
What is the SMILES notation for 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid?
The canonical SMILES for 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid is O=C(O)N1CCC(OCC(=O)N2CCOCC2)CC1.
What is the InChIKey of 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid?
The InChIKey is ZQIKIZSXZZPVDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O5/c15-11(13-5-7-18-8-6-13)9-19-10-1-3-14(4-2-10)12(16)17/h10H,1-9H2,(H,16,17).
What are the key properties of 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid?
4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid has a molecular weight of 272.30 g/mol, XLogP of 0.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid is sourced from PubChem (CID 123694815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).