Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 3Q22EPG4O8

Structure

InChI Key OHCXSLPXSUWTKQ-UHFFFAOYSA-N
Smiles CC1(C)COC(=N1)N
InChI
InChI=1S/C5H10N2O/c1-5(2)3-8-4(6)7-5/h3H2,1-2H3,(H2,6,7)

Physicochemical Descriptors

Property Name Value
Molecular Formula C5H10N2O1
Molecular Weight 114.08
AlogP 0.32
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Polar Surface Area 45.11
Heavy Atoms 8.0

Cross References

Resources Reference
CAS NUMBER 52832-91-4
NORMAN SUSDAT
FDA SRS 3Q22EPG4O8