Molecule

ID:33193

General Information
Structure
MolImage
Molecular Formula
C₅H₁₀ClNO
Molecular Mass
135.592
Exact Mass
135.04509163
Charge
0
InChI
InChI=1S/C5H10ClNO/c1-3-7(2)5(8)4-6/h3-4H2,1-2H3
InChIKey
YBYWLBWGIPIYIC-UHFFFAOYSA-N
Canonic Smiles
CCN(C(=O)CCl)C
Isomeric Smiles
C(=O)(N(CC)C)CCl
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
0.31121558
LogD (pH = 7.4)
0.31121558
Log P
0.31121558
Molar Refractivity
33.7611
Polarizability
13.025647
Polar Surface Area
20.31
Rotatable Bonds
2
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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