Molecule

ID:34628

General Information
Structure
MolImage
Molecular Formula
C₅H₁₀N₂O
Molecular Mass
114.1457
Exact Mass
114.07931295
Charge
0
InChI
InChI=1S/C5H10N2O/c6-7-5(8)4-2-1-3-4/h4H,1-3,6H2,(H,7,8)
InChIKey
KYUUPPKLZSVGMG-UHFFFAOYSA-N
Canonic Smiles
NNC(=O)C1CCC1
Isomeric Smiles
C1CCC1C(=O)NN
Calculated Properties
JChem
Acid pKa
13.092432
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-0.10491442
LogD (pH = 7.4)
-0.10243177
Log P
-0.10239913
Molar Refractivity
30.9502
Polarizability
11.862813
Polar Surface Area
55.12
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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