CC1=NC(=CC=C1)C(=O)CC2=CC=C(C=C2)F
CAS: 476472-56-7
Nom: 2-(4-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanone
SMILES: CC1=NC(=CC=C1)C(=O)CC2=CC=C(C=C2)F

Molecular Processing

Molecular formula
C14H12FNO
Molecular weight
229.25
Exact mass
229.0903
XLogP
2.95
TPSA
29.96
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
63.41

Supplementary Information

InChIKey: HMAHITRAFPEBFM-UHFFFAOYSA-N
Synonymes
476472-56-72-(4-fluorophenyl)-1-(6-methylpyridin-2-yl)ethanone2-(4-Fluorophenyl)-1-(6-methylpyridine-2-yl)ethanone2-(4-fluorophenyl)-1-(6-methylpyridin-2-yl)ethan-1-oneMFCD07367794SCHEMBL52355692-(4-fluoro-phenyl)-1-(6-methyl-pyridin-2-yl)-ethanoneDTXSID20621291HMAHITRAFPEBFM-UHFFFAOYSA-NAKOS012863921DS-5191AC-139272-(4-fluorophenyl)-1-(6-methyl-2-pyridyl)ethanone
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Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→