CC(N)c1cnn(-c2ccc(F)cc2)c1.Cl
Name: 1-(1-(4-fluorophenyl)-1H-pyrazol-4-yl)ethanamine hydrochloride
SMILES: CC(N)c1cnn(-c2ccc(F)cc2)c1.Cl

Molecular Processing

Molecular formula
C11H13ClFN3
Molecular weight
241.7
Exact mass
241.0782
XLogP
2.45
TPSA
43.84
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
2
Fraction Csp3
0.182
Molar refractivity
63.37

Supplementary Information

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