Molecule
ID:26224
General Information
Molecular Formula
C₁₁H₂₃N
Molecular Mass
169.30702
Exact Mass
169.18304974
Charge
0
InChI
InChI=1S/C11H23N/c1-4-11(2,3)9-5-7-10(12)8-6-9/h9-10H,4-8,12H2,1-3H3
InChIKey
KEOJIGZPVOCBMK-UHFFFAOYSA-N
Canonic Smiles
CCC(C1CCC(CC1)N)(C)C
Isomeric Smiles
C(C1CCC(N)CC1)(CC)(C)C
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-0.09091047
LogD (pH = 7.4)
0.19414392
Log P
2.9370344
Molar Refractivity
53.7073
Polarizability
21.833244
Polar Surface Area
26.02
Rotatable Bonds
2
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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