Molecule

ID:24371

General Information
Structure
MolImage
Molecular Formula
C₉H₂₀N₂
Molecular Mass
156.2685
Exact Mass
156.16264865
Charge
0
InChI
InChI=1S/C9H20N2/c10-7-4-8-11-9-5-2-1-3-6-9/h9,11H,1-8,10H2
InChIKey
ITZPOSYADVYECJ-UHFFFAOYSA-N
Canonic Smiles
NCCCNC1CCCCC1
Isomeric Smiles
N(C1CCCCC1)CCCN
Calculated Properties
JChem
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-5.056075
LogD (pH = 7.4)
-3.284863
Log P
0.869368
Molar Refractivity
48.5228
Polarizability
19.657892
Polar Surface Area
38.05
Rotatable Bonds
4
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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