Molecule

ID:15749

General Information
Structure
MolImage
Molecular Formula
C₁₂H₂₄N₂
Molecular Mass
196.33236
Exact Mass
196.19394878
Charge
0
InChI
InChI=1S/C12H24N2/c13-10-11-6-8-14(9-7-11)12-4-2-1-3-5-12/h11-12H,1-10,13H2
InChIKey
ASZYPKIPAOTWDA-UHFFFAOYSA-N
Canonic Smiles
NCC1CCN(CC1)C1CCCCC1
Isomeric Smiles
C1C(CCN(C1)C1CCCCC1)CN
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-4.824449
LogD (pH = 7.4)
-3.6191278
Log P
1.6612185
Molar Refractivity
61.2021
Polarizability
24.457176
Polar Surface Area
29.26
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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