Molecule

ID:35683

General Information
Structure
MolImage
Molecular Formula
C₁₅H₂₄N₂
Molecular Mass
232.36446
Exact Mass
232.19394878
Charge
0
InChI
InChI=1S/C15H24N2/c1-12-3-4-13(2)15(9-12)11-17-7-5-14(10-16)6-8-17/h3-4,9,14H,5-8,10-11,16H2,1-2H3
InChIKey
HJXORANFTYABRY-UHFFFAOYSA-N
Canonic Smiles
NCC1CCN(CC1)Cc1cc(C)ccc1C
Isomeric Smiles
c1(CN2CCC(CC2)CN)c(ccc(c1)C)C
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-3.8346632
LogD (pH = 7.4)
-2.2834046
Log P
2.6132638
Molar Refractivity
74.8829
Polarizability
29.131536
Polar Surface Area
29.26
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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