Molecule

ID:107815

General Information
Structure
MolImage
Molecular Formula
C₁₄H₂₃N
Molecular Mass
205.33912
Exact Mass
205.18304974
Charge
0
InChI
InChI=1S/C14H23N/c1-3-5-12-15(13-6-4-2)14-10-8-7-9-11-14/h7-11H,3-6,12-13H2,1-2H3
InChIKey
FZPXKEPZZOEPGX-UHFFFAOYSA-N
Canonic Smiles
CCCCN(c1ccccc1)CCCC
Isomeric Smiles
CCCCN(CCCC)c1ccccc1
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
4.000796
LogD (pH = 7.4)
4.7058535
Log P
4.729088
Molar Refractivity
68.2338
Polarizability
26.272202
Polar Surface Area
3.24
Rotatable Bonds
7
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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