Cyclo(Pro-Pro)
PubChem CID: 529063
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | Cyclo(Pro-Pro), 6708-06-1, octahydro-5H,10H-dipyrrolo[1,2-a:1',2'-d]pyrazine-5,10-dione, 1,7-diazatricyclo[7.3.0.03,7]dodecane-2,8-dione, (5aS)-2,3,5abeta,6,7,8-Hexahydro-1H,5H-dipyrrolo[1,2-a, cyclo(Pro,Pro), Prolinanhydrid, Cyclo(-Pro-Pro-), Cyclo-Pro-Pro-diketopiperazine, SCHEMBL6365121, BKASXWPLSXFART-UHFFFAOYSA-, CHEBI:228280, HMS1664J08, BCD-3246, CCG-53364, STL510908, AKOS003600041, FS-6942, SR-01000642532-1, 1,7-diazatricyclo[7.3.0.0(3),?]dodecane-2,8-dione, Octahydro-dipyrrolo[1,2-a, 1',2'-d]pyrazine-5,10-dione, octahydro-5H,10H-dipyrrolo[1,2-a:1,2-d]pyrazine-5,10-dione, InChI=1/C10H14N2O2/c13-9-7-3-1-5-11(7)10(14)8-4-2-6-12(8)9/h7-8H,1-6H2 |
|---|---|
| Topological Polar Surface Area | 40.6 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 14.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 272.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1,7-diazatricyclo[7.3.0.03,7]dodecane-2,8-dione |
| Prediction Hob | 1.0 |
| Xlogp | 0.1 |
| Molecular Formula | C10H14N2O2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | BKASXWPLSXFART-UHFFFAOYSA-N |
| Fcsp3 | 0.8 |
| Logs | -1.049 |
| Rotatable Bond Count | 0.0 |
| Logd | -0.766 |
| Compound Name | Cyclo(Pro-Pro) |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 194.106 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 194.106 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 194.23 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -1.1072508 |
| Inchi | InChI=1S/C10H14N2O2/c13-9-7-3-1-5-11(7)10(14)8-4-2-6-12(8)9/h7-8H,1-6H2 |
| Smiles | C1CC2C(=O)N3CCCC3C(=O)N2C1 |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Psammosilene Tunicoides (Plant) Rel Props:Source_db:cmaup_ingredients