Molecule

ID:63183

General Information
Structure
MolImage
Molecular Formula
C₆H₁₄ClNO
Molecular Mass
151.63446
Exact Mass
151.07639175
Charge
0
InChI
InChI=1S/C6H13NO.ClH/c1-6(2)5-7-3-4-8-6;/h7H,3-5H2,1-2H3;1H
InChIKey
BVVMNSNLWMCMOP-UHFFFAOYSA-N
Canonic Smiles
CC1(C)CNCCO1.Cl
Isomeric Smiles
Cl.C1NCCOC1(C)C
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-2.6631846
LogD (pH = 7.4)
-1.0848658
Log P
0.28577277
Molar Refractivity
32.8249
Polarizability
13.269628
Polar Surface Area
21.26
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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