Piperazin-2-one
PubChem CID: 231360
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | Piperazin-2-one, 5625-67-2, 2-Piperazinone, 2-Oxopiperazine, Piperazinone, Piperazine-2-one, 2-ketopiperazine, MFCD01318687, K9H2S9K98E, DTXSID10282698, 3,4,5,6-tetrahydropyrazin-2-ol, NSC-27441, oxopiperazine, piperazinones, keto piperazine, 3-oxopiperazine, piperazin-3-one, piperizin-2-one, piperazin-2-on, 2-oxo-piperazine, 2-Piperazine-one, NSC27441, XJJ, 2-Oxopiperazine--d6, 2-Oxopiperazine, 97%, SCHEMBL5194, UNII-K9H2S9K98E, CHEBI:46846, DTXCID40233850, CHEBI:195071, ALBB-012180, BCP26674, CS-B0039, STR07287, UYB80371, NSC 27441, STK025825, STL301724, AKOS000269318, AKOS022140684, AC-1109, FP09657, PB23229, PS-9326, 2(1H)-PYRAZINONE, TETRAHYDRO-, BP-11215, HY-20128, SY002559, DB-031180, P1867, EN300-08705, Z56968535, F1775-0070, 629-162-6 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 41.1 |
| Hydrogen Bond Donor Count | 2.0 |
| Pfizer 3 75 Rule | False |
| Scaffold Graph Level | CC1CCCCC1 |
| Deep Smiles | O=CCNCCN6 |
| Heavy Atom Count | 7.0 |
| Classyfire Class | Carboxylic acids and derivatives |
| Scaffold Graph Node Level | OC1CNCCN1 |
| Classyfire Subclass | Amino acids, peptides, and analogues |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 81.8 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | piperazin-2-one |
| Veber Rule | True |
| Classyfire Superclass | Organic acids and derivatives |
| Xlogp | -1.1 |
| Gsk 4 400 Rule | True |
| Molecular Formula | C4H8N2O |
| Scaffold Graph Node Bond Level | O=C1CNCCN1 |
| Inchi Key | IWELDVXSEVIIGI-UHFFFAOYSA-N |
| Silicos It Class | Soluble |
| Rotatable Bond Count | 0.0 |
| Synonyms | piperazin-2-one |
| Esol Class | Highly soluble |
| Functional Groups | CNC, CNC(C)=O |
| Compound Name | Piperazin-2-one |
| Exact Mass | 100.064 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 100.064 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 100.12 |
| Gi Absorption | False |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C4H8N2O/c7-4-3-5-1-2-6-4/h5H,1-3H2,(H,6,7) |
| Smiles | C1CNC(=O)CN1 |
| Np Classifier Biosynthetic Pathway | Alkaloids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | False |
| Np Classifier Superclass | Lysine alkaloids |
- 1. Outgoing r'ship
FOUND_INto/from Jatropha Curcas (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2014.886965