About 4-[2-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]quinazolin-4-yl]morpholine
4-[2-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]quinazolin-4-yl]morpholine (PubChem CID 72706534) has the molecular formula C22H25N5O2
and a molecular weight of 391.48 g/mol. Its IUPAC name is 4-[2-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]quinazolin-4-yl]morpholine.
Molecular Properties
| Compound Name | 4-[2-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]quinazolin-4-yl]morpholine |
| PubChem CID | 72706534 |
| Molecular Formula | C22H25N5O2 |
| Molecular Weight | 391.48 g/mol |
| Exact Mass | 391.20 |
| IUPAC Name | 4-[2-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]quinazolin-4-yl]morpholine |
| SMILES | c1cc(COc2nc(N3CCOCC3)c3ccccc3n2)nc(N2CCCC2)c1 |
| InChI | InChI=1S/C22H25N5O2/c1-2-8-19-18(7-1)21(27-12-14-28-15-13-27)25-22(24-19)29-16-17-6-5-9-20(23-17)26-10-3-4-11-26/h1-2,5-9H,3-4,10-16H2 |
| InChIKey | MYJWKEABNQTIOY-UHFFFAOYSA-N |
| XLogP | 3.04 |
| TPSA | 63.61 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 29 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 391.48 |
| LogP ≤ 5 | 3.04 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 7 |
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Frequently Asked Questions
What is the IUPAC name of 4-[2-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]quinazolin-4-yl]morpholine?
The IUPAC name of 4-[2-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]quinazolin-4-yl]morpholine (CID 72706534) is 4-[2-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]quinazolin-4-yl]morpholine.
What is the SMILES notation for 4-[2-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]quinazolin-4-yl]morpholine?
The canonical SMILES for 4-[2-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]quinazolin-4-yl]morpholine is c1cc(COc2nc(N3CCOCC3)c3ccccc3n2)nc(N2CCCC2)c1.
What is the InChIKey of 4-[2-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]quinazolin-4-yl]morpholine?
The InChIKey is MYJWKEABNQTIOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N5O2/c1-2-8-19-18(7-1)21(27-12-14-28-15-13-27)25-22(24-19)29-16-17-6-5-9-20(23-17)26-10-3-4-11-26/h1-2,5-9H,3-4,10-16H2.
What are the key properties of 4-[2-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]quinazolin-4-yl]morpholine?
4-[2-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]quinazolin-4-yl]morpholine has a molecular weight of 391.48 g/mol, XLogP of 3.04, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(6-pyrrolidin-1-yl-2-pyridinyl)methoxy]quinazolin-4-yl]morpholine is sourced from PubChem (CID 72706534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).