About 2-(quinolin-4-ylmethyl)morpholine
2-(quinolin-4-ylmethyl)morpholine (PubChem CID 116985426) has the molecular formula C14H16N2O
and a molecular weight of 228.30 g/mol. Its IUPAC name is 2-(quinolin-4-ylmethyl)morpholine.
Molecular Properties
| Compound Name | 2-(quinolin-4-ylmethyl)morpholine |
| PubChem CID | 116985426 |
| Molecular Formula | C14H16N2O |
| Molecular Weight | 228.30 g/mol |
| Exact Mass | 228.13 |
| IUPAC Name | 2-(quinolin-4-ylmethyl)morpholine |
| SMILES | c1ccc2c(CC3CNCCO3)ccnc2c1 |
| InChI | InChI=1S/C14H16N2O/c1-2-4-14-13(3-1)11(5-6-16-14)9-12-10-15-7-8-17-12/h1-6,12,15H,7-10H2 |
| InChIKey | IPNWMAPSGKNQBV-UHFFFAOYSA-N |
| XLogP | 1.77 |
| TPSA | 34.15 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 228.30 |
| LogP ≤ 5 | 1.77 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(quinolin-4-ylmethyl)morpholine?
The IUPAC name of 2-(quinolin-4-ylmethyl)morpholine (CID 116985426) is 2-(quinolin-4-ylmethyl)morpholine.
What is the SMILES notation for 2-(quinolin-4-ylmethyl)morpholine?
The canonical SMILES for 2-(quinolin-4-ylmethyl)morpholine is c1ccc2c(CC3CNCCO3)ccnc2c1.
What is the InChIKey of 2-(quinolin-4-ylmethyl)morpholine?
The InChIKey is IPNWMAPSGKNQBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-2-4-14-13(3-1)11(5-6-16-14)9-12-10-15-7-8-17-12/h1-6,12,15H,7-10H2.
What are the key properties of 2-(quinolin-4-ylmethyl)morpholine?
2-(quinolin-4-ylmethyl)morpholine has a molecular weight of 228.30 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(quinolin-4-ylmethyl)morpholine is sourced from PubChem (CID 116985426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).