| MolName | N-[(E)-(1-amino-2,2,2-trifluoroethylidene)amino]-2,2,2-trifluoroacetamide |
| MolecularFormula | C4H3N3OF6 |
| Smiles | N/C(/C(F)(F)F)=N/NC(C(F)(F)F)=O |
| InChI | InChI=1S/C4H3F6N3O/c5-3(6,7)1(11)12-13-2(14)4(8,9)10/h(H2,11,12)(H,13,14) |
| InChIK | ANQWQPHOLAKDED-UHFFFAOYSA-N |
| TotalMolweight | 223.076 |
| Molweight | 223.076 |
| MonoisotopicMass | 223.01803 |
| CLogP | 0.4366 |
| CLogS | -2.626 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 133.12 |
| Relative PSA | 0.38522 |
| PolarSurfaceArea | 67.48 |
| Druglikeness | -28.823 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.57143 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 10 |
| Electronegative Atoms | 10 |
| Rotatable Bond | 3 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| StereoCon |
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1 - N-[(E)-(1-amino-2,2,2-trifluoroethylidene)amino]-2,2,2-trifluoroacetamide | 2 - N-[(E)-(1-amino-2,2,2-trifluoroethylidene)amino]-2,2,2-trifluoroacetamide