Molecule

ID:52062

General Information
Structure
MolImage
Molecular Formula
C₄H₁₀N₂O
Molecular Mass
102.135
Exact Mass
102.07931295
Charge
0
InChI
InChI=1S/C4H10N2O/c1-2-3-4(7)6-5/h2-3,5H2,1H3,(H,6,7)
InChIKey
FCCCRBDJBTVFSJ-UHFFFAOYSA-N
Canonic Smiles
CCCC(=O)NN
Isomeric Smiles
C(=O)(CCC)NN
Calculated Properties
JChem
Acid pKa
13.383523
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-0.18421307
LogD (pH = 7.4)
-0.18169221
Log P
-0.1816595
Molar Refractivity
28.1779
Polarizability
10.746768
Polar Surface Area
55.12
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
No Data Available
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Molecule Details
References
Bioactivity
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