Molecule

ID:76930

General Information
Structure
MolImage
Molecular Formula
C₆H₁₄N₂
Molecular Mass
114.18876
Exact Mass
114.11569846
Charge
0
InChI
InChI=1S/C6H14N2/c7-5-6-3-1-2-4-8-6/h6,8H,1-5,7H2
InChIKey
RHPBLLCTOLJFPH-UHFFFAOYSA-N
Canonic Smiles
NCC1CCCCN1
Isomeric Smiles
N1CCCCC1CN
Calculated Properties
JChem
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-4.9061584
LogD (pH = 7.4)
-2.8531988
Log P
-0.07972908
Molar Refractivity
34.4554
Polarizability
14.118806
Polar Surface Area
38.05
Rotatable Bonds
1
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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