Synonyms
Status
Molecule Category Free-form
UNII 4AW7F70MZO
EPA CompTox DTXSID20869732

Structure

InChI Key XTXXOHPHLNROBN-UHFFFAOYSA-N
Smiles O=C1CN2C(=O)CCC2N1
InChI
InChI=1S/C6H8N2O2/c9-5-3-8-4(7-5)1-2-6(8)10/h4H,1-3H2,(H,7,9)

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H8N2O2
Molecular Weight 140.14
AlogP -0.94
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Polar Surface Area 49.41
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 10.0

Cross References

Resources Reference
CAS NUMBER 126100-97-8
ChEMBL CHEMBL337612
DrugBank DB13018
FDA SRS 4AW7F70MZO
PubChem 65955
SureChEMBL SCHEMBL195256