Molecule

ID:71814

General Information
Structure
MolImage
Molecular Formula
C₁₂H₂₄N₂
Molecular Mass
196.33236
Exact Mass
196.19394878
Charge
0
InChI
InChI=1S/C12H24N2/c13-8-5-11-6-9-14(10-7-11)12-3-1-2-4-12/h11-12H,1-10,13H2
InChIKey
SQPZDQJSVACOTO-UHFFFAOYSA-N
Canonic Smiles
NCCC1CCN(CC1)C1CCCC1
Isomeric Smiles
N1(CCC(CC1)CCN)C1CCCC1
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-4.8928843
LogD (pH = 7.4)
-3.5496612
Log P
1.5832648
Molar Refractivity
61.2791
Polarizability
24.457176
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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