Molecule

ID:16655

General Information
Structure
MolImage
Molecular Formula
C₉H₂₀N₂
Molecular Mass
156.2685
Exact Mass
156.16264865
Charge
0
InChI
InChI=1S/C9H20N2/c10-6-5-9-11-7-3-1-2-4-8-11/h1-10H2
InChIKey
FXTRRLIESPAUHT-UHFFFAOYSA-N
Canonic Smiles
NCCCN1CCCCCC1
Isomeric Smiles
N1(CCCN)CCCCCC1
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-5.1739635
LogD (pH = 7.4)
-3.1724262
Log P
0.7480802
Molar Refractivity
49.5463
Polarizability
19.657892
Polar Surface Area
29.26
Rotatable Bonds
3
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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