Molecule

ID:97144

General Information

Structure

Molecular Formula

C₅F₁₁N

Molecular Mass

283.0426352

Exact Mass

282.98550943

Charge

0

InChI

InChI=1S/C5F11N/c6-1(7)2(8,9)4(12,13)17(16)5(14,15)3(1,10)11

InChIKey

VCEAGMYKGZNUFL-UHFFFAOYSA-N

Canonic Smiles

FN1C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F

Isomeric Smiles

N1(C(F)(F)C(C(C(C1(F)F)(F)F)(F)F)(F)F)F

Calculated Properties

JChem

H Acceptors

1

H Donor

0

LogD (pH = 5.5)

3.5297613

LogD (pH = 7.4)

3.5297613

Log P

3.5297613

Molar Refractivity

28.5599

Polarizability

11.128529

Polar Surface Area

3.24

Rotatable Bonds

0

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