Molecule

ID:74309

General Information

Structure

MolImage

Molecular Formula

C₁₀H₂₀N₂O

Molecular Mass

184.2786

Exact Mass

184.15756327

Charge

0

InChI

InChI=1S/C10H20N2O/c1-2-3-4-5-10(13)12-8-6-11-7-9-12/h11H,2-9H2,1H3

InChIKey

ZVWWNYWKAQNQTM-UHFFFAOYSA-N

Canonic Smiles

CCCCCC(=O)N1CCNCC1

Isomeric Smiles

N1(C(=O)CCCCC)CCNCC1

Calculated Properties

JChem

H Acceptors

2

H Donor

1

LogD (pH = 5.5)

-1.3595179

LogD (pH = 7.4)

0.3545359

Log P

0.91537726

Molar Refractivity

53.4446

Polarizability

21.152966

Polar Surface Area

32.34

Rotatable Bonds

4

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