Molecule

ID:28809

General Information
Structure
Molecular Formula
C₁₄H₂₄N₂
Molecular Mass
220.35376
Exact Mass
220.19394878
Charge
0
InChI
InChI=1S/C14H24N2/c1-3-16(4-2)13-12-15-11-10-14-8-6-5-7-9-14/h5-9,15H,3-4,10-13H2,1-2H3
InChIKey
WUIFHYMUVDPLHT-UHFFFAOYSA-N
Canonic Smiles
CCN(CCNCCc1ccccc1)CC
Isomeric Smiles
N(CCNCCc1ccccc1)(CC)CC
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-2.2331595
LogD (pH = 7.4)
-0.012582666
Log P
2.5525162
Molar Refractivity
71.5773
Polarizability
28.11342
Polar Surface Area
15.27
Rotatable Bonds
8
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
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References
Bioactivity
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