Molecule

ID:71408

General Information

Structure

MolImage

Molecular Formula

C₄H₉N

Molecular Mass

71.12096

Exact Mass

71.07349929

Charge

0

InChI

InChI=1S/C4H9N/c1-4(2)3-5-4/h5H,3H2,1-2H3

InChIKey

FGRJGEWVJCCOJJ-UHFFFAOYSA-N

Canonic Smiles

CC1(C)NC1

Isomeric Smiles

C1NC1(C)C

Calculated Properties

JChem

H Acceptors

1

H Donor

1

LogD (pH = 5.5)

-2.006039

LogD (pH = 7.4)

-0.28183353

Log P

0.33274826

Molar Refractivity

21.7814

Polarizability

8.905697

Polar Surface Area

21.94

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

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Molecule Details

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References

Bioactivity