Molecule

ID:57178

General Information
Structure
MolImage
Molecular Formula
C₁₀H₂₀N₂O₂
Molecular Mass
200.278
Exact Mass
200.15247789
Charge
0
InChI
InChI=1S/C10H20N2O2/c1-4-14-10(13)9(2)12-7-5-11(3)6-8-12/h9H,4-8H2,1-3H3
InChIKey
LYCVPFCDPTXHQX-UHFFFAOYSA-N
Canonic Smiles
CCOC(=O)C(N1CCN(CC1)C)C
Isomeric Smiles
C1CN(CCN1C)C(C)C(=O)OCC
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
-1.6779569
LogD (pH = 7.4)
0.04991306
Log P
0.5867386
Molar Refractivity
56.1344
Polarizability
22.239014
Polar Surface Area
32.78
Rotatable Bonds
4
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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