Molecule

ID:65955

General Information
Structure
MolImage
Molecular Formula
C₅H₁₀ClN
Molecular Mass
119.5926
Exact Mass
119.05017701
Charge
0
InChI
InChI=1S/C5H9N.ClH/c6-5-1-4(2-5)3-5;/h4H,1-3,6H2;1H
InChIKey
LQKLVOWNBKJRJE-UHFFFAOYSA-N
Canonic Smiles
NC12CC(C1)C2.Cl
Isomeric Smiles
C12(CC(C1)C2)N.Cl
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-3.0034266
LogD (pH = 7.4)
-2.6255043
Log P
0.021929264
Molar Refractivity
24.4376
Polarizability
10.013423
Polar Surface Area
26.02
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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