Molecule

ID:13581

General Information
Structure
MolImage
Molecular Formula
C₁₅H₂₄N₂
Molecular Mass
232.36446
Exact Mass
232.19394878
Charge
0
InChI
InChI=1S/C15H24N2/c1-3-17-11-9-15(10-12-17)16-13(2)14-7-5-4-6-8-14/h4-8,13,15-16H,3,9-12H2,1-2H3
InChIKey
FCHIXBOAKWKZHI-UHFFFAOYSA-N
Canonic Smiles
CCN1CCC(CC1)NC(c1ccccc1)C
Isomeric Smiles
C1C(CCN(C1)CC)NC(c1ccccc1)C
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-2.9361281
LogD (pH = 7.4)
-0.68497175
Log P
2.3317838
Molar Refractivity
73.9245
Polarizability
29.293894
Polar Surface Area
15.27
Rotatable Bonds
4
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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