Structure

InChI Key FGSJNNQVSUVTPW-UHFFFAOYSA-N
Smile CNC(C)Cc1ccccc1OC.Cl
InChI
InChI=1S/C11H17NO.ClH/c1-9(12-2)8-10-6-4-5-7-11(10)13-3;/h4-7,9,12H,8H2,1-3H3;1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H18ClNO
Molecular Weight 215.72
AlogP 1.85
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 21.26
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 13.0

Cross References

Resources Reference
ChEBI 31830
ChEMBL CHEMBL1985928
FDA SRS 52V8BVV7FX
PubChem 9859211
SureChEMBL SCHEMBL208636