Molecule

ID:17462

General Information
Structure
MolImage
Molecular Formula
C₈H₁₈N₂
Molecular Mass
142.24192
Exact Mass
142.14699859
Charge
0
InChI
InChI=1S/C8H18N2/c9-5-4-8-10-6-2-1-3-7-10/h1-9H2
InChIKey
JMUCXULQKPWSTJ-UHFFFAOYSA-N
Canonic Smiles
NCCCN1CCCCC1
Isomeric Smiles
N1(CCCN)CCCCC1
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-5.3878226
LogD (pH = 7.4)
-3.2768192
Log P
0.30351153
Molar Refractivity
44.9453
Polarizability
17.811394
Polar Surface Area
29.26
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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