Molecule

ID:18867

General Information
Structure
MolImage
Molecular Formula
C₉H₂₀N₂
Molecular Mass
156.2685
Exact Mass
156.16264865
Charge
0
InChI
InChI=1S/C9H20N2/c1-2-5-11-6-3-9(8-10)4-7-11/h9H,2-8,10H2,1H3
InChIKey
QSUUJNCKEJEANG-UHFFFAOYSA-N
Canonic Smiles
CCCN1CCC(CC1)CN
Isomeric Smiles
N1(CCC(CC1)CN)CCC
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-5.7507
LogD (pH = 7.4)
-4.5050807
Log P
0.74127835
Molar Refractivity
49.4605
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
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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