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

Structure

InChI Key GAZQWEXWEDYOKU-UHFFFAOYSA-N
Smiles C1CCC(CC1)N1CNCN(C1)C1CCCCC1
InChI
InChI=1S/C15H29N3/c1-3-7-14(8-4-1)17-11-16-12-18(13-17)15-9-5-2-6-10-15/h14-16H,1-13H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H29N3
Molecular Weight 251.24
AlogP 2.73
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 18.51
Heavy Atoms 18.0

Cross References

Resources Reference
NORMAN SUSDAT