Molecule

ID:107214

General Information
Structure
MolImage
Molecular Formula
C₁₁H₂₆N₂
Molecular Mass
186.33754
Exact Mass
186.20959884
Charge
0
InChI
InChI=1S/C11H26N2/c1-3-13(4-2)11-9-7-5-6-8-10-12/h3-12H2,1-2H3
InChIKey
OMJKSFGVIXXFFY-UHFFFAOYSA-N
Canonic Smiles
NCCCCCCCN(CC)CC
Isomeric Smiles
CCN(CC)CCCCCCCN
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-4.487481
LogD (pH = 7.4)
-3.410837
Log P
2.01783
Molar Refractivity
60.7481
Polarizability
24.093277
Polar Surface Area
29.26
Rotatable Bonds
9
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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