Molecule

ID:18773

General Information
Structure
MolImage
Molecular Formula
C₉H₂₀N₂
Molecular Mass
156.2685
Exact Mass
156.16264865
Charge
0
InChI
InChI=1S/C9H20N2/c1-11(2)8-7-10-9-5-3-4-6-9/h9-10H,3-8H2,1-2H3
InChIKey
MXTNPQHZAUREOU-UHFFFAOYSA-N
Canonic Smiles
CN(CCNC1CCCC1)C
Isomeric Smiles
N(CCN(C)C)C1CCCC1
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-3.1513686
LogD (pH = 7.4)
-1.615551
Log P
1.180468
Molar Refractivity
49.1257
Polarizability
19.657892
Polar Surface Area
15.27
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
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