Molecule

ID:136854

General Information
Structure
MolImage
Molecular Formula
C₆H₁₆N₂
Molecular Mass
116.20464
Exact Mass
116.13134852
Charge
0
InChI
InChI=1S/C6H16N2/c7-5-3-1-2-4-6-8/h1-8H2
InChIKey
NAQMVNRVTILPCV-UHFFFAOYSA-N
Canonic Smiles
NCCCCCCN
Isomeric Smiles
C(CCCN)CCN
Calculated Properties
JChem
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-6.003959
LogD (pH = 7.4)
-5.1644053
Log P
0.044017065
Molar Refractivity
36.5806
Polarizability
14.858968
Polar Surface Area
52.04
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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