Molecule

ID:107253

General Information

Structure

MolImage

Molecular Formula

C₈H₂₀N₂

Molecular Mass

144.2578

Exact Mass

144.16264865

Charge

0

InChI

InChI=1S/C8H20N2/c1-5-10(6-2)8-7-9(3)4/h5-8H2,1-4H3

InChIKey

YUKZJEQIDOFUPV-UHFFFAOYSA-N

Canonic Smiles

CCN(CCN(C)C)CC

Isomeric Smiles

CCN(CC)CCN(C)C

Calculated Properties

JChem

H Acceptors

2

H Donor

0

LogD (pH = 5.5)

-2.829717

LogD (pH = 7.4)

-1.4256732

Log P

0.9224299

Molar Refractivity

47.5044

Polarizability

18.552586

Polar Surface Area

6.48

Rotatable Bonds

5

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