Molecule

ID:33450

General Information
Structure
MolImage
Molecular Formula
C₉H₁₉N
Molecular Mass
141.25386
Exact Mass
141.15174961
Charge
0
InChI
InChI=1S/C9H19N/c1-8(2)10-6-4-9(3)5-7-10/h8-9H,4-7H2,1-3H3
InChIKey
IGCABXIFWGCNDH-UHFFFAOYSA-N
Canonic Smiles
CC1CCN(CC1)C(C)C
Isomeric Smiles
N1(CCC(CC1)C)C(C)C
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
-1.3805424
LogD (pH = 7.4)
-0.7262723
Log P
2.1009376
Molar Refractivity
45.8461
Polarizability
18.13941
Polar Surface Area
3.24
Rotatable Bonds
1
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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