Molecule

ID:13867

General Information
Structure
MolImage
Molecular Formula
C₁₀H₂₀N₂O
Molecular Mass
184.2786
Exact Mass
184.15756327
Charge
0
InChI
InChI=1S/C10H20N2O/c1-9-4-11-5-10(2,8(9)13)7-12(3)6-9/h8,11,13H,4-7H2,1-3H3
InChIKey
HDNDFGNEEKOHMW-UHFFFAOYSA-N
Canonic Smiles
CN1CC2(C)CNCC(C1)(C2O)C
Isomeric Smiles
C1(C2(CN(CC1(CNC2)C)C)C)O
Calculated Properties
JChem
Acid pKa
14.171011
H Acceptors
3
H Donor
2
LogD (pH = 5.5)
-5.1733685
LogD (pH = 7.4)
-2.7870495
Log P
-0.26568732
Molar Refractivity
52.9512
Polarizability
21.362965
Polar Surface Area
35.5
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
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References
Bioactivity
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