About 4-[1-[(6Z)-1-ethenyl-6-ethylidene-3-methyl-2-pyridinyl]ethenyl]morpholine
4-[1-[(6Z)-1-ethenyl-6-ethylidene-3-methyl-2-pyridinyl]ethenyl]morpholine (PubChem CID 142300925) has the molecular formula C16H22N2O
and a molecular weight of 258.37 g/mol. Its IUPAC name is 4-[1-[(6Z)-1-ethenyl-6-ethylidene-3-methyl-2-pyridinyl]ethenyl]morpholine.
Molecular Properties
| Compound Name | 4-[1-[(6Z)-1-ethenyl-6-ethylidene-3-methyl-2-pyridinyl]ethenyl]morpholine |
| PubChem CID | 142300925 |
| Molecular Formula | C16H22N2O |
| Molecular Weight | 258.37 g/mol |
| Exact Mass | 258.17 |
| IUPAC Name | 4-[1-[(6Z)-1-ethenyl-6-ethylidene-3-methyl-2-pyridinyl]ethenyl]morpholine |
| SMILES | C=CN1C(C(=C)N2CCOCC2)=C(C)C=C/C1=C/C |
| InChI | InChI=1S/C16H22N2O/c1-5-15-8-7-13(3)16(18(15)6-2)14(4)17-9-11-19-12-10-17/h5-8H,2,4,9-12H2,1,3H3/b15-5- |
| InChIKey | LSJFYSNELHLJAV-WCSRMQSCSA-N |
| XLogP | 3.03 |
| TPSA | 15.71 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 258.37 |
| LogP ≤ 5 | 3.03 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-[1-[(6Z)-1-ethenyl-6-ethylidene-3-methyl-2-pyridinyl]ethenyl]morpholine?
The IUPAC name of 4-[1-[(6Z)-1-ethenyl-6-ethylidene-3-methyl-2-pyridinyl]ethenyl]morpholine (CID 142300925) is 4-[1-[(6Z)-1-ethenyl-6-ethylidene-3-methyl-2-pyridinyl]ethenyl]morpholine.
What is the SMILES notation for 4-[1-[(6Z)-1-ethenyl-6-ethylidene-3-methyl-2-pyridinyl]ethenyl]morpholine?
The canonical SMILES for 4-[1-[(6Z)-1-ethenyl-6-ethylidene-3-methyl-2-pyridinyl]ethenyl]morpholine is C=CN1C(C(=C)N2CCOCC2)=C(C)C=C/C1=C/C.
What is the InChIKey of 4-[1-[(6Z)-1-ethenyl-6-ethylidene-3-methyl-2-pyridinyl]ethenyl]morpholine?
The InChIKey is LSJFYSNELHLJAV-WCSRMQSCSA-N. The full InChI is InChI=1S/C16H22N2O/c1-5-15-8-7-13(3)16(18(15)6-2)14(4)17-9-11-19-12-10-17/h5-8H,2,4,9-12H2,1,3H3/b15-5-.
What are the key properties of 4-[1-[(6Z)-1-ethenyl-6-ethylidene-3-methyl-2-pyridinyl]ethenyl]morpholine?
4-[1-[(6Z)-1-ethenyl-6-ethylidene-3-methyl-2-pyridinyl]ethenyl]morpholine has a molecular weight of 258.37 g/mol, XLogP of 3.03, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[(6Z)-1-ethenyl-6-ethylidene-3-methyl-2-pyridinyl]ethenyl]morpholine is sourced from PubChem (CID 142300925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).