Molecule

ID:23560

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₅N
Molecular Mass
149.2328
Exact Mass
149.12044949
Charge
0
InChI
InChI=1S/C10H15N/c1-3-11-9(2)10-7-5-4-6-8-10/h4-9,11H,3H2,1-2H3
InChIKey
GJKPTDGTWOVONJ-UHFFFAOYSA-N
Canonic Smiles
CCNC(c1ccccc1)C
Isomeric Smiles
c1(C(NCC)C)ccccc1
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-0.90547335
LogD (pH = 7.4)
-0.09386685
Log P
2.3049777
Molar Refractivity
48.4734
Polarizability
19.290514
Polar Surface Area
12.03
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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