Molecule

ID:58222

General Information
Structure
MolImage
Molecular Formula
C₇H₁₅N
Molecular Mass
113.2007
Exact Mass
113.12044949
Charge
0
InChI
InChI=1S/C7H15N/c1-7-3-2-5-8-6-4-7/h7-8H,2-6H2,1H3
InChIKey
WKZHYWWKUYGHKO-UHFFFAOYSA-N
Canonic Smiles
CC1CCNCCC1
Isomeric Smiles
N1CCC(C)CCC1
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-1.847528
LogD (pH = 7.4)
-1.552651
Log P
1.3890754
Molar Refractivity
35.985
Polarizability
14.445701
Polar Surface Area
12.03
Rotatable Bonds
0
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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