About 3-[2-(azetidin-1-yl)propyl]morpholine
3-[2-(azetidin-1-yl)propyl]morpholine (PubChem CID 130548634) has the molecular formula C10H20N2O
and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-[2-(azetidin-1-yl)propyl]morpholine.
Molecular Properties
| Compound Name | 3-[2-(azetidin-1-yl)propyl]morpholine |
| PubChem CID | 130548634 |
| Molecular Formula | C10H20N2O |
| Molecular Weight | 184.28 g/mol |
| Exact Mass | 184.16 |
| IUPAC Name | 3-[2-(azetidin-1-yl)propyl]morpholine |
| SMILES | CC(CC1COCCN1)N1CCC1 |
| InChI | InChI=1S/C10H20N2O/c1-9(12-4-2-5-12)7-10-8-13-6-3-11-10/h9-11H,2-8H2,1H3 |
| InChIKey | WGNBMYYWWFJMHV-UHFFFAOYSA-N |
| XLogP | 0.46 |
| TPSA | 24.50 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 184.28 |
| LogP ≤ 5 | 0.46 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 3-[2-(azetidin-1-yl)propyl]morpholine?
The IUPAC name of 3-[2-(azetidin-1-yl)propyl]morpholine (CID 130548634) is 3-[2-(azetidin-1-yl)propyl]morpholine.
What is the SMILES notation for 3-[2-(azetidin-1-yl)propyl]morpholine?
The canonical SMILES for 3-[2-(azetidin-1-yl)propyl]morpholine is CC(CC1COCCN1)N1CCC1.
What is the InChIKey of 3-[2-(azetidin-1-yl)propyl]morpholine?
The InChIKey is WGNBMYYWWFJMHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-9(12-4-2-5-12)7-10-8-13-6-3-11-10/h9-11H,2-8H2,1H3.
What are the key properties of 3-[2-(azetidin-1-yl)propyl]morpholine?
3-[2-(azetidin-1-yl)propyl]morpholine has a molecular weight of 184.28 g/mol, XLogP of 0.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(azetidin-1-yl)propyl]morpholine is sourced from PubChem (CID 130548634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).