Molecule

ID:58963

General Information
Structure
MolImage
Molecular Formula
C₁₀H₂₀N₂
Molecular Mass
168.2792
Exact Mass
168.16264865
Charge
0
InChI
InChI=1S/C10H20N2/c1-12-7-4-10(5-8-12)3-2-6-11-9-10/h11H,2-9H2,1H3
InChIKey
DPAUGPILPAZRRD-UHFFFAOYSA-N
Canonic Smiles
CN1CCC2(CC1)CCCNC2
Isomeric Smiles
C12(CCN(CC1)C)CNCCC2
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-6.058271
LogD (pH = 7.4)
-4.8088684
Log P
0.64356506
Molar Refractivity
52.23
Polarizability
20.7646
Polar Surface Area
15.27
Rotatable Bonds
0
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
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References
Bioactivity
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