Molecule

ID:87273

General Information
Structure
MolImage
Molecular Formula
C₅H₁₂N₂
Molecular Mass
100.16218
Exact Mass
100.10004839
Charge
0
InChI
InChI=1S/C5H12N2/c6-7-4-2-1-3-5-7/h1-6H2
InChIKey
LWMPFIOTEAXAGV-UHFFFAOYSA-N
Canonic Smiles
NN1CCCCC1
Isomeric Smiles
N1(CCCCC1)N
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-0.66642547
LogD (pH = 7.4)
-0.036162924
Log P
-0.017654063
Molar Refractivity
31.3195
Polarizability
12.067715
Polar Surface Area
29.26
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Loading...
Names and Identifiers
Loading...
Registration numbers
Loading...
Properties
Loading...
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
Loading...
References
Loading...
Bioactivity
Loading...