Molecule

ID:136604

General Information
Structure
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Molecular Formula
C₃H₉N
Molecular Mass
62.08822451
Exact Mass
62.08356381
Charge
0
InChI
InChI=1S/C3H9N/c1-3(2)4/h3H,4H2,1-2H3/i1+1,2+1,3+1
InChIKey
JJWLVOIRVHMVIS-VMIGTVKRSA-N
Canonic Smiles
[13CH3][13CH](N)[13CH3]
Isomeric Smiles
[13CH3][13CH]([13CH3])N
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-2.879705
LogD (pH = 7.4)
-2.5821686
Log P
0.14792411
Molar Refractivity
19.0862
Polarizability
7.800994
Polar Surface Area
26.02
Rotatable Bonds
0
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
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
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Bioactivity
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