Molecule

ID:15740

General Information
Structure
MolImage
Molecular Formula
C₁₁H₂₀N₂O
Molecular Mass
196.2893
Exact Mass
196.15756327
Charge
0
InChI
InChI=1S/C11H20N2O/c14-11(10-5-4-6-12-9-10)13-7-2-1-3-8-13/h10,12H,1-9H2
InChIKey
OSZRYTYCKGZYLB-UHFFFAOYSA-N
Canonic Smiles
O=C(N1CCCCC1)C1CCCNC1
Isomeric Smiles
N1CC(CCC1)C(=O)N1CCCCC1
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-2.6590807
LogD (pH = 7.4)
-1.6406491
Log P
0.5269153
Molar Refractivity
56.6789
Polarizability
22.265976
Polar Surface Area
32.34
Rotatable Bonds
1
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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