Molecule
ID:126367
General Information
Molecular Formula
C₁₄H₁₉N
Molecular Mass
201.30736
Exact Mass
201.15174961
Charge
0
InChI
InChI=1S/C14H19N/c1-15-14-12-8-7-11(9-12)13(14)10-5-3-2-4-6-10/h2-6,11-15H,7-9H2,1H3
InChIKey
CTVMYAZECFXZLN-UHFFFAOYSA-N
Canonic Smiles
CNC1C2CCC(C1c1ccccc1)C2
Isomeric Smiles
C1CC2CC1C(NC)C2c1ccccc1
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-0.38533822
LogD (pH = 7.4)
-0.0054953946
Log P
2.8488662
Molar Refractivity
62.8912
Polarizability
25.10768
Polar Surface Area
12.03
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Loading...
Names and Identifiers
Loading...
Registration numbers
Loading...
Properties
No Data Available
Click here to submit data
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
Loading...
References
Loading...
Bioactivity
Loading...