Molecule

ID:34658

General Information
Structure
MolImage
Molecular Formula
C₄H₁₀N₂
Molecular Mass
86.1356
Exact Mass
86.08439833
Charge
0
InChI
InChI=1S/C4H10N2/c5-4-1-2-6-3-4/h4,6H,1-3,5H2
InChIKey
NGXSWUFDCSEIOO-UHFFFAOYSA-N
Canonic Smiles
NC1CNCC1
Isomeric Smiles
N1CCC(N)C1
Calculated Properties
JChem
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-6.116508
LogD (pH = 7.4)
-4.3484693
Log P
-1.0416604
Molar Refractivity
25.2098
Polarizability
10.427217
Polar Surface Area
38.05
Rotatable Bonds
0
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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