Molecule

ID:59186

General Information
Structure
MolImage
Molecular Formula
C₈H₁₅N
Molecular Mass
125.2114
Exact Mass
125.12044949
Charge
0
InChI
InChI=1S/C8H15N/c1-7(2)8-3-5-9-6-4-8/h9H,3-6H2,1-2H3
InChIKey
SRYVUMHANHOENO-UHFFFAOYSA-N
Canonic Smiles
CC(=C1CCNCC1)C
Isomeric Smiles
C1CNCCC1=C(C)C
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-1.9727993
LogD (pH = 7.4)
-1.0560364
Log P
1.2268572
Molar Refractivity
41.117
Polarizability
16.06087
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
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References
Bioactivity
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