Molecule

ID:104686

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₅N
Molecular Mass
149.2328
Exact Mass
149.12044949
Charge
0
InChI
InChI=1S/C10H15N/c1-8-5-9(2)7-10(6-8)11(3)4/h5-7H,1-4H3
InChIKey
NBFRQCOZERNGEX-UHFFFAOYSA-N
Canonic Smiles
Cc1cc(C)cc(c1)N(C)C
Isomeric Smiles
CN(C)c1cc(C)cc(C)c1
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
2.8957317
LogD (pH = 7.4)
3.1046953
Log P
3.1081324
Molar Refractivity
50.569
Polarizability
18.72139
Polar Surface Area
3.24
Rotatable Bonds
1
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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