CC1=NC(=C(C=C1)OCC2=C(C=CC=C2F)F)N
Name: 3-[(2,6-difluorophenyl)methoxy]-6-methylpyridin-2-amine
SMILES: CC1=NC(=C(C=C1)OCC2=C(C=CC=C2F)F)N

Molecular Processing

Molecular formula
C13H12F2N2O
Molecular weight
250.25
Exact mass
250.0918
XLogP
2.83
TPSA
48.14
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
64.08

Supplementary Information

InChIKey: RUDZANBDJMIRRK-UHFFFAOYSA-N
Synonyms
SCHEMBL9125447RUDZANBDJMIRRK-UHFFFAOYSA-N2-amino-3-(2,6-difluorobenzyloxy)-6-methyl-pyridine2-Amino-3-(2,6-difluorobenzyloxy)-6-methylpyridine
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Involved in 4 reactions