Molecule

ID:34652

General Information
Structure
Molecular Formula
C₈H₁₄N₂
Molecular Mass
138.21016
Exact Mass
138.11569846
Charge
0
InChI
InChI=1S/C8H14N2/c9-5-1-2-6-10-7-3-4-8-10/h1-4,6-8H2
InChIKey
OSDDDHPYSNZBPF-UHFFFAOYSA-N
Canonic Smiles
N#CCCCN1CCCC1
Isomeric Smiles
N#CCCCN1CCCC1
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
-2.593692
LogD (pH = 7.4)
-1.0535796
Log P
0.65757304
Molar Refractivity
42.0474
Polarizability
16.10553
Polar Surface Area
27.03
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
References
Bioactivity
Navigation