| CID | 16 |
| pubchem_compound_canonicalized | 1 |
| pubchem_cactvs_complexity | 205 |
| pubchem_cactvs_hbond_acceptor | 2 |
| pubchem_cactvs_hbond_donor | 2 |
| pubchem_cactvs_rotatable_bond | 0 |
| pubchem_cactvs_subskeys | AAADceBzMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHgAQAAAACADBgAQAAALAAAAIAAEQEAAAAAAAAAAAAIEIAAAAABIAgAAEAAAAFgCAAAEYCAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== |
| pubchem_iupac_openeye_name | 7,14-diazacyclotetradecane-1,8-dione |
| pubchem_iupac_cas_name | 7,14-diazacyclotetradecane-1,8-dione |
| pubchem_iupac_systematic_name | 7,14-diazacyclotetradecane-1,8-dione |
| pubchem_iupac_traditional_name | 7,14-diazacyclotetradecane-1,8-quinone |
| pubchem_nist_inchi | InChI=1S/C12H22N2O2/c15-11-7-3-1-5-9-13-12(16)8-4-2-6-10-14-11/h1-10H2,(H,13,16)(H,14,15) |
| pubchem_cactvs_xlogp | 0 |
| pubchem_exact_mass | 226.168128 |
| pubchem_molecular_formula | C12H22N2O2 |
| pubchem_molecular_weight | 226.31528 |
| pubchem_openeye_can_smiles | C1CCC(=O)NCCCCCC(=O)NCC1 |
| pubchem_openeye_iso_smiles | C1CCC(=O)NCCCCCC(=O)NCC1 |
| pubchem_cactvs_tpsa | 58.2 |
| pubchem_monoisotopic_weight | 226.168128 |
| pubchem_total_charge | 0 |
| pubchem_heavy_atom_count | 16 |
| pubchem_atom_def_stereo_count | 0 |
| pubchem_atom_udef_stereo_count | 0 |
| pubchem_bond_def_stereo_count | 0 |
| pubchem_bond_udef_stereo_count | 0 |
| pubchem_isotopic_atom_count | 0 |
| pubchem_component_count | 1 |
| pubchem_cactvs_tauto_count | 6 |
