Molecule

ID:15025

General Information
Structure
MolImage
Molecular Formula
C₅H₁₁NO
Molecular Mass
101.14694
Exact Mass
101.08406398
Charge
0
InChI
InChI=1S/C5H11NO/c6-5-1-3-7-4-2-5/h5H,1-4,6H2
InChIKey
AHVQYHFYQWKUKB-UHFFFAOYSA-N
Canonic Smiles
NC1CCOCC1
Isomeric Smiles
C1CC(CCO1)N
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-3.690344
LogD (pH = 7.4)
-3.336105
Log P
-0.6642728
Molar Refractivity
28.3943
Polarizability
11.428371
Polar Surface Area
35.25
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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