A1DO5
Summary
| Name: | N-[4-(propan-2-yl)phenyl]morpholine-4-carboxamide |
| Formula: | C14 H20 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 248.321 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | N-[4-(propan-2-yl)phenyl]morpholine-4-carboxamide |
| OpenEye OEToolkits | 3.1.0.0 | ~{N}-(4-propan-2-ylphenyl)morpholine-4-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(Nc1ccc(cc1)C(C)C)N1CCOCC1 |
| InChI | InChI | 1.06 | InChI=1S/C14H20N2O2/c1-11(2)12-3-5-13(6-4-12)15-14(17)16-7-9-18-10-8-16/h3-6,11H,7-10H2,1-2H3,(H,15,17) |
| InChIKey | InChI | 1.06 | VNFQCEIAWZAABJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)c1ccc(NC(=O)N2CCOCC2)cc1 |
| SMILES | CACTVS | 3.385 | CC(C)c1ccc(NC(=O)N2CCOCC2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CC(C)c1ccc(cc1)NC(=O)N2CCOCC2 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC(C)c1ccc(cc1)NC(=O)N2CCOCC2 |
