Structure

InChI Key ZRIHAIZYIMGOAB-UHFFFAOYSA-N
Smile CCC(C)C1(CC)C(=O)NC(=O)NC1=O
InChI
InChI=1S/C10H16N2O3/c1-4-6(3)10(5-2)7(13)11-9(15)12-8(10)14/h6H,4-5H2,1-3H3,(H2,11,12,13,14,15)

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H16N2O3
Molecular Weight 212.25
AlogP 0.79
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 3.0
Polar Surface Area 75.27
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 15.0

Cross References

Resources Reference
ChEBI 3228
ChEMBL CHEMBL449
DrugBank DB00237
DrugCentral 439
EPA CompTox DTXSID2022709
FDA SRS P0078O25A9
Human Metabolome Database HMDB0014382
Guide to Pharmacology 7137
KEGG C07827
PharmGKB PA164743463
SureChEMBL SCHEMBL79254