Molecule

ID:38175

General Information
Structure
MolImage
Molecular Formula
C₈H₁₆N₂
Molecular Mass
140.22604
Exact Mass
140.13134852
Charge
0
InChI
InChI=1S/C8H16N2/c1-3-8-7-9-4-2-6-10(8)5-1/h8-9H,1-7H2
InChIKey
QBNOLQLKVNGFCG-UHFFFAOYSA-N
Canonic Smiles
C1NCC2N(CC1)CCC2
Isomeric Smiles
N1CCCN2C(C1)CCC2
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-5.605197
LogD (pH = 7.4)
-3.8026142
Log P
0.17976539
Molar Refractivity
42.8201
Polarizability
17.072641
Polar Surface Area
15.27
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
Molecule Details
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References
Bioactivity
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