About [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone
[4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone (PubChem CID 101130657) has the molecular formula C19H22N2O2
and a molecular weight of 310.40 g/mol. Its IUPAC name is [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone.
Molecular Properties
| Compound Name | [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone |
| PubChem CID | 101130657 |
| Molecular Formula | C19H22N2O2 |
| Molecular Weight | 310.40 g/mol |
| Exact Mass | 310.17 |
| IUPAC Name | [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone |
| SMILES | CN(C)c1ccc(C(=O)c2ccc(N3CCOCC3)cc2)cc1 |
| InChI | InChI=1S/C19H22N2O2/c1-20(2)17-7-3-15(4-8-17)19(22)16-5-9-18(10-6-16)21-11-13-23-14-12-21/h3-10H,11-14H2,1-2H3 |
| InChIKey | JMISXHBYWWCNFO-UHFFFAOYSA-N |
| XLogP | 2.82 |
| TPSA | 32.78 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 310.40 |
| LogP ≤ 5 | 2.82 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone?
The IUPAC name of [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone (CID 101130657) is [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone.
What is the SMILES notation for [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone?
The canonical SMILES for [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone is CN(C)c1ccc(C(=O)c2ccc(N3CCOCC3)cc2)cc1.
What is the InChIKey of [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone?
The InChIKey is JMISXHBYWWCNFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-20(2)17-7-3-15(4-8-17)19(22)16-5-9-18(10-6-16)21-11-13-23-14-12-21/h3-10H,11-14H2,1-2H3.
What are the key properties of [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone?
[4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone has a molecular weight of 310.40 g/mol, XLogP of 2.82, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(dimethylamino)phenyl]-(4-morpholin-4-ylphenyl)methanone is sourced from PubChem (CID 101130657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).