Molecule

ID:24378

General Information
Structure
MolImage
Molecular Formula
C₆H₁₆N₂
Molecular Mass
116.20464
Exact Mass
116.13134852
Charge
0
InChI
InChI=1S/C6H16N2/c1-6(2)8-5-3-4-7/h6,8H,3-5,7H2,1-2H3
InChIKey
KFDIDIIKNMZLRZ-UHFFFAOYSA-N
Canonic Smiles
NCCCNC(C)C
Isomeric Smiles
N(CCCN)C(C)C
Calculated Properties
JChem
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-6.0194097
LogD (pH = 7.4)
-4.1553373
Log P
-0.15651956
Molar Refractivity
36.676
Polarizability
14.858968
Polar Surface Area
38.05
Rotatable Bonds
4
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