Molecule

ID:24510

General Information
Structure
MolImage
Molecular Formula
C₈H₂₀N₂
Molecular Mass
144.2578
Exact Mass
144.16264865
Charge
0
InChI
InChI=1S/C8H20N2/c1-4-10(5-2)8-6-7-9-3/h9H,4-8H2,1-3H3
InChIKey
SMJVVYQWUFKTKZ-UHFFFAOYSA-N
Canonic Smiles
CNCCCN(CC)CC
Isomeric Smiles
N(CCCNC)(CC)CC
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-5.4983344
LogD (pH = 7.4)
-3.4293242
Log P
0.5993417
Molar Refractivity
47.0751
Polarizability
18.552586
Polar Surface Area
15.27
Rotatable Bonds
6
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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