Molecule

ID:24313

General Information
Structure
MolImage
Molecular Formula
C₉H₁₉N
Molecular Mass
141.25386
Exact Mass
141.15174961
Charge
0
InChI
InChI=1S/C9H19N/c1-2-10-9-7-5-3-4-6-8-9/h9-10H,2-8H2,1H3
InChIKey
VFPQRGMSTSEZFW-UHFFFAOYSA-N
Canonic Smiles
CCNC1CCCCCC1
Isomeric Smiles
N(C1CCCCCC1)CC
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-0.83078396
LogD (pH = 7.4)
-0.62026435
Log P
2.4077687
Molar Refractivity
45.0572
Polarizability
18.13941
Polar Surface Area
12.03
Rotatable Bonds
2
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
References
Bioactivity
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