Molecule

ID:35013

General Information
Structure
Molecular Formula
C₁₄H₂₆N₂O
Molecular Mass
238.36904
Exact Mass
238.20451346
Charge
0
InChI
InChI=1S/C14H26N2O/c1-12(17)16-10-8-14(9-11-16)15-13-6-4-2-3-5-7-13/h13-15H,2-11H2,1H3
InChIKey
WYBHTMKHSRKCFJ-UHFFFAOYSA-N
Canonic Smiles
CC(=O)N1CCC(CC1)NC1CCCCCC1
Isomeric Smiles
N1(C(=O)C)CCC(NC2CCCCCC2)CC1
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-1.9341873
LogD (pH = 7.4)
-1.7380443
Log P
1.3046612
Molar Refractivity
70.0309
Polarizability
27.793371
Polar Surface Area
32.34
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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