N-[2-(N-ethyl-2-methylanilino)ethyl]-2,3-dimethoxy-5-morpholin-4-ylsulfonylbenzamide
C24H33N3O6S — CID 46478502
Data last refreshed: (MolForge compound catalog, from PubChem)
About N-[2-(N-ethyl-2-methylanilino)ethyl]-2,3-dimethoxy-5-morpholin-4-ylsulfonylbenzamide
N-[2-(N-ethyl-2-methylanilino)ethyl]-2,3-dimethoxy-5-morpholin-4-ylsulfonylbenzamide (PubChem CID 46478502) has the molecular formula C24H33N3O6S and a molecular weight of 491.61 g/mol. Its IUPAC name is N-[2-(N-ethyl-2-methylanilino)ethyl]-2,3-dimethoxy-5-morpholin-4-ylsulfonylbenzamide.
Molecular Properties
| Compound Name | N-[2-(N-ethyl-2-methylanilino)ethyl]-2,3-dimethoxy-5-morpholin-4-ylsulfonylbenzamide |
|---|---|
| PubChem CID | 46478502 |
| Molecular Formula | C24H33N3O6S |
| Molecular Weight | 491.61 g/mol |
| Exact Mass | 491.21 |
| IUPAC Name | N-[2-(N-ethyl-2-methylanilino)ethyl]-2,3-dimethoxy-5-morpholin-4-ylsulfonylbenzamide |
| SMILES | CCN(CCNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cc(OC)c1OC)c1ccccc1C |
| InChI | InChI=1S/C24H33N3O6S/c1-5-26(21-9-7-6-8-18(21)2)11-10-25-24(28)20-16-19(17-22(31-3)23(20)32-4)34(29,30)27-12-14-33-15-13-27/h6-9,16-17H,5,10-15H2,1-4H3,(H,25,28) |
| InChIKey | JPUDPASJTZESGQ-UHFFFAOYSA-N |
| XLogP | 2.29 |
| TPSA | 97.41 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Heavy Atoms | 34 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 491.61 |
| LogP ≤ 5 | 2.29 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 7 |
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Sources
- PubChem CID 46478502 — identifiers, structure, computed properties (public domain)
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