Structure

InChI Key FTOAOBMCPZCFFF-UHFFFAOYSA-N
Smile CCC1(CC)C(=O)NC(=O)NC1=O
InChI
InChI=1S/C8H12N2O3/c1-3-8(4-2)5(11)9-7(13)10-6(8)12/h3-4H2,1-2H3,(H2,9,10,11,12,13)

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H12N2O3
Molecular Weight 184.19
AlogP 0.16
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 2.0
Polar Surface Area 75.27
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 13.0

Cross References

Resources Reference
ChEBI 31252
ChEMBL CHEMBL444
DrugBank DB01483
DrugCentral 289
EPA CompTox DTXSID5022643
FDA SRS 5WZ53ENE2P
PharmGKB PA448538
PubChem 2294
SureChEMBL SCHEMBL43818
ZINC ZINC000013545632