About 1-(4-piperidin-1-ylsulfonylmorpholin-2-yl)ethanamine
1-(4-piperidin-1-ylsulfonylmorpholin-2-yl)ethanamine (PubChem CID 113285038) has the molecular formula C11H23N3O3S
and a molecular weight of 277.39 g/mol. Its IUPAC name is 1-(4-piperidin-1-ylsulfonylmorpholin-2-yl)ethanamine.
Molecular Properties
| Compound Name | 1-(4-piperidin-1-ylsulfonylmorpholin-2-yl)ethanamine |
| PubChem CID | 113285038 |
| Molecular Formula | C11H23N3O3S |
| Molecular Weight | 277.39 g/mol |
| Exact Mass | 277.15 |
| IUPAC Name | 1-(4-piperidin-1-ylsulfonylmorpholin-2-yl)ethanamine |
| SMILES | CC(N)C1CN(S(=O)(=O)N2CCCCC2)CCO1 |
| InChI | InChI=1S/C11H23N3O3S/c1-10(12)11-9-14(7-8-17-11)18(15,16)13-5-3-2-4-6-13/h10-11H,2-9,12H2,1H3 |
| InChIKey | LJNKMRHUWOJZCH-UHFFFAOYSA-N |
| XLogP | -0.23 |
| TPSA | 75.87 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 277.39 |
| LogP ≤ 5 | -0.23 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 1-(4-piperidin-1-ylsulfonylmorpholin-2-yl)ethanamine?
The IUPAC name of 1-(4-piperidin-1-ylsulfonylmorpholin-2-yl)ethanamine (CID 113285038) is 1-(4-piperidin-1-ylsulfonylmorpholin-2-yl)ethanamine.
What is the SMILES notation for 1-(4-piperidin-1-ylsulfonylmorpholin-2-yl)ethanamine?
The canonical SMILES for 1-(4-piperidin-1-ylsulfonylmorpholin-2-yl)ethanamine is CC(N)C1CN(S(=O)(=O)N2CCCCC2)CCO1.
What is the InChIKey of 1-(4-piperidin-1-ylsulfonylmorpholin-2-yl)ethanamine?
The InChIKey is LJNKMRHUWOJZCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3S/c1-10(12)11-9-14(7-8-17-11)18(15,16)13-5-3-2-4-6-13/h10-11H,2-9,12H2,1H3.
What are the key properties of 1-(4-piperidin-1-ylsulfonylmorpholin-2-yl)ethanamine?
1-(4-piperidin-1-ylsulfonylmorpholin-2-yl)ethanamine has a molecular weight of 277.39 g/mol, XLogP of -0.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-piperidin-1-ylsulfonylmorpholin-2-yl)ethanamine is sourced from PubChem (CID 113285038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).