Molecule

ID:108564

General Information
Structure
Molecular Formula
C₁₄H₂₇N
Molecular Mass
209.37088
Exact Mass
209.21434987
Charge
0
InChI
InChI=1S/C14H27N/c1-2-6-10-13(9-5-1)15-14-11-7-3-4-8-12-14/h13-15H,1-12H2
InChIKey
LYFALQJXGVLXBL-UHFFFAOYSA-N
Canonic Smiles
C1CCCCC(C1)NC1CCCCCC1
Isomeric Smiles
C1CCCC(CC1)NC1CCCCCC1
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
1.0540576
LogD (pH = 7.4)
1.1441894
Log P
4.2948
Molar Refractivity
65.9238
Polarizability
26.631351
Polar Surface Area
12.03
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
Molecule Details
References
Bioactivity
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