Molecule

ID:33379

General Information
Structure
MolImage
Molecular Formula
C₈H₁₄N₂
Molecular Mass
138.21016
Exact Mass
138.11569846
Charge
0
InChI
InChI=1S/C8H14N2/c9-5-8-10-6-3-1-2-4-7-10/h1-4,6-8H2
InChIKey
OHKGIEVCPHMZKY-UHFFFAOYSA-N
Canonic Smiles
N#CCN1CCCCCC1
Isomeric Smiles
N#CCN1CCCCCC1
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
0.19243419
LogD (pH = 7.4)
0.99068755
Log P
1.0210364
Molar Refractivity
41.795
Polarizability
16.10553
Polar Surface Area
27.03
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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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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