Molecule

ID:19496

General Information
Structure
MolImage
Molecular Formula
C₁₄H₂₆N₂
Molecular Mass
222.36964
Exact Mass
222.20959884
Charge
0
InChI
InChI=1S/C14H26N2/c1-16(13-5-3-2-4-6-13)14-9-11-7-8-12(10-14)15-11/h11-15H,2-10H2,1H3
InChIKey
XLFOFZOBMGBKMZ-UHFFFAOYSA-N
Canonic Smiles
CN(C1CC2CCC(C1)N2)C1CCCCC1
Isomeric Smiles
C1(N(C2CCCCC2)C)CC2NC(C1)CC2
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-4.276526
LogD (pH = 7.4)
-2.609006
Log P
2.1585298
Molar Refractivity
68.0401
Polarizability
27.410402
Polar Surface Area
15.27
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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