Molecule

ID:31413

General Information
Structure
MolImage
Molecular Formula
C₁₃H₂₃N
Molecular Mass
193.32842
Exact Mass
193.18304974
Charge
0
InChI
InChI=1S/C13H23N/c1-10-4-11(2)6-12(3,5-10)9-13(14,7-10)8-11/h4-9,14H2,1-3H3
InChIKey
XOEUSMBMGXZZJL-UHFFFAOYSA-N
Canonic Smiles
CC12CC3(C)CC(C1)(C)CC(C2)(C3)N
Isomeric Smiles
C12(CC3(CC(C1)(CC(C2)(C3)C)C)C)N
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-0.66400266
LogD (pH = 7.4)
-0.47528756
Log P
2.3660889
Molar Refractivity
58.9609
Polarizability
24.043682
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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