Molecule

ID:136207

General Information
Structure
MolImage
Molecular Formula
C₉H₂₁N
Molecular Mass
143.26974
Exact Mass
143.16739968
Charge
0
InChI
InChI=1S/C9H21N/c1-3-4-5-6-7-8-9(2)10/h9H,3-8,10H2,1-2H3/t9-/m1/s1
InChIKey
ALXIFCUEJWCQQL-SECBINFHSA-N
Canonic Smiles
CCCCCCC[C@H](N)C
Isomeric Smiles
CCCCCCC[C@@H](C)N
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-0.13437094
LogD (pH = 7.4)
0.16193035
Log P
2.8932898
Molar Refractivity
46.6152
Polarizability
18.883202
Polar Surface Area
26.02
Rotatable Bonds
6
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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