Molecule

ID:24329

General Information
Structure
MolImage
Molecular Formula
C₉H₂₀N₂
Molecular Mass
156.2685
Exact Mass
156.16264865
Charge
0
InChI
InChI=1S/C9H20N2/c1-3-10-7-9-5-6-11(4-2)8-9/h9-10H,3-8H2,1-2H3
InChIKey
JMAGSGRQNWLQKT-UHFFFAOYSA-N
Canonic Smiles
CCNCC1CCN(C1)CC
Isomeric Smiles
N1(CC(CC1)CNCC)CC
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-5.3991017
LogD (pH = 7.4)
-3.3803563
Log P
0.6051324
Molar Refractivity
49.7599
Polarizability
19.657892
Polar Surface Area
15.27
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
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References
Bioactivity
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