Molecule

ID:122902

General Information
Structure
MolImage
Molecular Formula
C₆H₁₀N₂
Molecular Mass
110.157
Exact Mass
110.08439833
Charge
0
InChI
InChI=1S/C6H10N2/c1-5(2)6-7-3-4-8-6/h3-5H,1-2H3,(H,7,8)
InChIKey
FUOZJYASZOSONT-UHFFFAOYSA-N
Canonic Smiles
CC(c1ncc[nH]1)C
Isomeric Smiles
c1(ncc[nH]1)C(C)C
Calculated Properties
JChem
Acid pKa
13.667928
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
0.22032113
LogD (pH = 7.4)
1.008583
Log P
1.2213626
Molar Refractivity
32.6549
Polarizability
12.586387
Polar Surface Area
28.68
Rotatable Bonds
1
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
No Data Available
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Molecule Details
References
Bioactivity
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