Molecule

ID:17208

General Information
Structure
MolImage
Molecular Formula
C₁₀H₂₂N₂
Molecular Mass
170.29508
Exact Mass
170.17829871
Charge
0
InChI
InChI=1S/C10H22N2/c1-9-6-4-5-7-12(9)8-10(2,3)11/h9H,4-8,11H2,1-3H3
InChIKey
FRAJFMOTJCQVOA-UHFFFAOYSA-N
Canonic Smiles
CC1CCCCN1CC(N)(C)C
Isomeric Smiles
N1(C(CCCC1)C)CC(C)(C)N
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-2.810086
LogD (pH = 7.4)
-1.5772547
Log P
1.3572785
Molar Refractivity
53.5557
Polarizability
21.50448
Polar Surface Area
29.26
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
Molecule Details
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References
Bioactivity
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