Molecule

ID:27145

General Information
Structure
MolImage
Molecular Formula
C₁₆H₃₄N₂O
Molecular Mass
270.45396
Exact Mass
270.26711372
Charge
0
InChI
InChI=1S/C16H34N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(19)18-17/h2-15,17H2,1H3,(H,18,19)
InChIKey
SSVSELJXJJCANX-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCCCC(=O)NN
Isomeric Smiles
C(=O)(NN)CCCCCCCCCCCCCCC
Calculated Properties
JChem
Acid pKa
13.358329
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
5.150611
LogD (pH = 7.4)
5.153132
Log P
5.1531644
Molar Refractivity
83.3899
Polarizability
32.847603
Polar Surface Area
55.12
Rotatable Bonds
14
Lipinski's Rule of Five
false
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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