Molecule

ID:34668

General Information
Structure
MolImage
Molecular Formula
C₁₀H₂₂N₂
Molecular Mass
170.29508
Exact Mass
170.17829871
Charge
0
InChI
InChI=1S/C10H22N2/c1-2-3-4-5-8-12-9-6-11-7-10-12/h11H,2-10H2,1H3
InChIKey
WRFUXAYDZDQDKY-UHFFFAOYSA-N
Canonic Smiles
CCCCCCN1CCNCC1
Isomeric Smiles
N1(CCCCCC)CCNCC1
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-1.6018896
LogD (pH = 7.4)
-0.2694151
Log P
1.8672775
Molar Refractivity
53.8191
Polarizability
21.50448
Polar Surface Area
15.27
Rotatable Bonds
5
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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