Structure

InChI Key WRONACHIHQGZSD-UHFFFAOYSA-N
Smile CCN(C)C(C)C(O)c1ccccc1.Cl
InChI
InChI=1S/C12H19NO.ClH/c1-4-13(3)10(2)12(14)11-8-6-5-7-9-11;/h5-10,12,14H,4H2,1-3H3;1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H20ClNO
Molecular Weight 229.75
AlogP 2.06
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 23.47
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 14.0

Cross References

Resources Reference
ChEMBL CHEMBL2106678
FDA SRS Y134VQ304Y
PubChem 76964725
SureChEMBL SCHEMBL123128