Molecule

ID:17626

General Information
Structure
MolImage
Molecular Formula
C₁₂H₂₄N₂
Molecular Mass
196.33236
Exact Mass
196.19394878
Charge
0
InChI
InChI=1S/C12H24N2/c1-2-9-14(10-3-1)11-6-12-4-7-13-8-5-12/h12-13H,1-11H2
InChIKey
FKYVHDSPGMMDFF-UHFFFAOYSA-N
Canonic Smiles
C1CCN(CC1)CCC1CCNCC1
Isomeric Smiles
C1(CCN2CCCCC2)CCNCC1
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-5.183257
LogD (pH = 7.4)
-3.8466349
Log P
1.5115094
Molar Refractivity
61.7825
Polarizability
24.457176
Polar Surface Area
15.27
Rotatable Bonds
3
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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