Molecule

ID:71439

General Information
Structure
MolImage
Molecular Formula
C₁₄H₂₅NO₄
Molecular Mass
271.3526
Exact Mass
271.17835829
Charge
0
InChI
InChI=1S/C14H25NO4/c1-14(2,3)19-13(17)11-8-6-7-10(9-11)12(16)15(4)18-5/h10-11H,6-9H2,1-5H3
InChIKey
MBKIVTOKCDBBBW-UHFFFAOYSA-N
Canonic Smiles
CON(C(=O)C1CCCC(C1)C(=O)OC(C)(C)C)C
Isomeric Smiles
C(=O)(C1CC(C(=O)OC(C)(C)C)CCC1)N(OC)C
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
2.1042671
LogD (pH = 7.4)
2.1042671
Log P
2.1042671
Molar Refractivity
71.6263
Polarizability
28.487598
Polar Surface Area
55.84
Rotatable Bonds
5
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
Molecular Spectra
Molecule Details
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References
Bioactivity
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