CC1=CC(=C(C=C1NC(=O)C)N)F
Nom: N-(5-amino-4-fluoro-2-methylphenyl)acetamide
SMILES: CC1=CC(=C(C=C1NC(=O)C)N)F

Molecular Processing

Molecular formula
C9H11FN2O
Molecular weight
182.2
Exact mass
182.0855
XLogP
1.67
TPSA
55.12
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
49.85

Supplementary Information

InChIKey: NHNXRUARPQOKHZ-UHFFFAOYSA-N
Synonymes
SCHEMBL13480206
Voir la source →
Impliqué dans 3 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→