Molecule

ID:63800

General Information
Structure
MolImage
Molecular Formula
C₁₄H₂₄N₂O₃
Molecular Mass
268.35196
Exact Mass
268.17869264
Charge
0
InChI
InChI=1S/C14H24N2O3/c1-13(2,3)19-12(18)16-10-5-4-7-14(16)8-6-9-15-11(14)17/h4-10H2,1-3H3,(H,15,17)
InChIKey
NFCRQDOCGHYPRW-UHFFFAOYSA-N
Canonic Smiles
O=C(N1CCCCC21CCCNC2=O)OC(C)(C)C
Isomeric Smiles
N1(CCCCC21CCCNC2=O)C(=O)OC(C)(C)C
Calculated Properties
JChem
Acid pKa
14.319644
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
1.5291091
LogD (pH = 7.4)
1.5291091
Log P
1.5291091
Molar Refractivity
71.885
Polarizability
28.19876
Polar Surface Area
58.64
Rotatable Bonds
2
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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