Molecule

ID:65922

General Information
Structure
MolImage
Molecular Formula
C₉H₁₅N
Molecular Mass
137.2221
Exact Mass
137.12044949
Charge
0
InChI
InChI=1S/C9H15N/c1-2-6-9(5-1)10-7-3-4-8-10/h5H,1-4,6-8H2
InChIKey
KOFSFYBXUYHNJL-UHFFFAOYSA-N
Canonic Smiles
C1CC=C(C1)N1CCCC1
Isomeric Smiles
C1CC=C(C1)N1CCCC1
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
-1.8589487
LogD (pH = 7.4)
-1.1415843
Log P
1.6184121
Molar Refractivity
45.4357
Polarizability
16.758333
Polar Surface Area
3.24
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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