Molecule

ID:27340

General Information
Structure
MolImage
Molecular Formula
C₄H₁₀N₂O
Molecular Mass
102.135
Exact Mass
102.07931295
Charge
0
InChI
InChI=1S/C4H10N2O/c1-3(2)4(7)6-5/h3H,5H2,1-2H3,(H,6,7)
InChIKey
PLNNJQXIITYYTN-UHFFFAOYSA-N
Canonic Smiles
NNC(=O)C(C)C
Isomeric Smiles
C(=O)(NN)C(C)C
Calculated Properties
JChem
Acid pKa
13.345756
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-0.0857625
LogD (pH = 7.4)
-0.08327422
Log P
-0.083241895
Molar Refractivity
28.1514
Polarizability
10.746768
Polar Surface Area
55.12
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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