Molecule

ID:71029

General Information
Structure
MolImage
Molecular Formula
C₅H₁₀N₂O
Molecular Mass
114.1457
Exact Mass
114.07931295
Charge
0
InChI
InChI=1S/C5H10N2O/c1-7-3-2-6-5(8)4-7/h2-4H2,1H3,(H,6,8)
InChIKey
KVIZTDNKHOCNAM-UHFFFAOYSA-N
Canonic Smiles
CN1CCNC(=O)C1
Isomeric Smiles
N1C(=O)CN(CC1)C
Calculated Properties
JChem
Acid pKa
14.552153
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-2.3080492
LogD (pH = 7.4)
-1.1651059
Log P
-1.0866387
Molar Refractivity
30.8226
Polarizability
11.95924
Polar Surface Area
32.34
Rotatable Bonds
0
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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