Molecule

ID:74412

General Information
Structure
MolImage
Molecular Formula
C₈H₁₉N
Molecular Mass
129.24316
Exact Mass
129.15174961
Charge
0
InChI
InChI=1S/C8H19N/c1-6-9(7(2)3)8(4)5/h7-8H,6H2,1-5H3
InChIKey
JGFZNNIVVJXRND-UHFFFAOYSA-N
Canonic Smiles
CCN(C(C)C)C(C)C
Isomeric Smiles
N(CC)(C(C)C)C(C)C
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
-1.3996065
LogD (pH = 7.4)
-1.0124657
Log P
2.0937433
Molar Refractivity
43.0715
Polarizability
17.036163
Polar Surface Area
3.24
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
No Data Available
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Molecule Details
References
Bioactivity
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