Molecule

ID:33362

General Information
Structure
Molecular Formula
C₆H₁₆N₂
Molecular Mass
116.20464
Exact Mass
116.13134852
Charge
0
InChI
InChI=1S/C6H16N2/c1-6(4-5-7)8(2)3/h6H,4-5,7H2,1-3H3
InChIKey
HMNAAVUZNWPXDC-UHFFFAOYSA-N
Canonic Smiles
NCCC(N(C)C)C
Isomeric Smiles
N(C(CCN)C)(C)C
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-6.2058163
LogD (pH = 7.4)
-4.1203365
Log P
-0.13027959
Molar Refractivity
37.2221
Polarizability
14.858968
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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