Molecule

ID:47829

General Information
Structure
MolImage
Molecular Formula
C₁₅H₂₄N₂
Molecular Mass
232.36446
Exact Mass
232.19394878
Charge
0
InChI
InChI=1S/C15H24N2/c1-3-17(14-7-5-4-6-8-14)15-10-9-13(16)11-12(15)2/h9-11,14H,3-8,16H2,1-2H3
InChIKey
BZTWIDHVBYILDA-UHFFFAOYSA-N
Canonic Smiles
CCN(c1ccc(cc1C)N)C1CCCCC1
Isomeric Smiles
c1(N(C2CCCCC2)CC)c(cc(cc1)N)C
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
1.5856249
LogD (pH = 7.4)
3.281167
Log P
3.9218636
Molar Refractivity
75.991
Polarizability
28.408089
Polar Surface Area
29.26
Rotatable Bonds
3
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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