Structure

InChI Key MFYNHXMPPRNECN-UHFFFAOYSA-N
Smiles OC1=CC=CC=C1.C1CN=C2CCCCCN2C1
InChI
InChI=1S/C9H16N2.C6H6O/c1-2-5-9-10-6-4-8-11(9)7-3-1;7-6-4-2-1-3-5-6/h1-8H2;1-5,7H

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H22N2O
Molecular Weight 246.17
AlogP 3.06
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Polar Surface Area 35.83
Heavy Atoms 18.0

Cross References

Resources Reference
CAS NUMBER 57671-19-9
NORMAN SUSDAT