Molecule

ID:63851

General Information
Structure
MolImage
Molecular Formula
C₆H₁₅ClN₂
Molecular Mass
150.6497
Exact Mass
150.09237617
Charge
0
InChI
InChI=1S/C6H14N2.ClH/c1-6(4-7)2-3-8-5-6;/h8H,2-5,7H2,1H3;1H
InChIKey
FRQWHAZEJHQKRP-UHFFFAOYSA-N
Canonic Smiles
NCC1(C)CNCC1.Cl
Isomeric Smiles
Cl.CC1(CN)CCNC1
Calculated Properties
JChem
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-6.2145534
LogD (pH = 7.4)
-4.448124
Log P
-0.43176028
Molar Refractivity
34.5363
Polarizability
14.118806
Polar Surface Area
38.05
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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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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