Molecule

ID:69606

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₄N₂
Molecular Mass
162.23156
Exact Mass
162.11569846
Charge
0
InChI
InChI=1S/C10H14N2/c1-2-4-10(5-3-1)12-8-6-11-7-9-12/h1-5,11H,6-9H2
InChIKey
YZTJYBJCZXZGCT-UHFFFAOYSA-N
Canonic Smiles
N1CCN(CC1)c1ccccc1
Isomeric Smiles
N1(CCNCC1)c1ccccc1
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-1.4620405
LogD (pH = 7.4)
0.052540626
Log P
1.5453613
Molar Refractivity
51.242
Polarizability
19.658602
Polar Surface Area
15.27
Rotatable Bonds
1
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
No Data Available
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Molecule Details
References
Bioactivity
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