Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID70886974

Structure

InChI Key CFBJIFBQVHRWIP-UHFFFAOYSA-N
Smiles NC12CNCC(C)(CC(C)(C)C1)C2
InChI
InChI=1/C11H22N2/c1-9(2)4-10(3)6-11(12,5-9)8-13-7-10/h13H,4-8,12H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H22N2
Molecular Weight 182.18
AlogP 1.5
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Polar Surface Area 38.05
Heavy Atoms 13.0

Cross References

Resources Reference
CAS NUMBER 67873-92-1
NORMAN SUSDAT
PubChem 106925