Molecule

ID:41117

General Information
Structure
MolImage
Molecular Formula
C₆H₁₀N₂
Molecular Mass
110.157
Exact Mass
110.08439833
Charge
0
InChI
InChI=1S/C6H10N2/c7-3-6-8-4-1-2-5-8/h1-2,4-5H,3,6-7H2
InChIKey
HPDIRFBJYSOVKW-UHFFFAOYSA-N
Canonic Smiles
NCCn1cccc1
Isomeric Smiles
n1(cccc1)CCN
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-2.5238516
LogD (pH = 7.4)
-1.7374724
Log P
0.4798222
Molar Refractivity
33.6633
Polarizability
13.173365
Polar Surface Area
30.95
Rotatable Bonds
2
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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