CC1(CCC(=O)N1)C(F)(F)F
Name: 5-methyl-5-(trifluoromethyl)pyrrolidin-2-one
SMILES: CC1(CCC(=O)N1)C(F)(F)F

Molecular Processing

Molecular formula
C6H8F3NO
Molecular weight
167.13
Exact mass
167.0558
XLogP
1.22
TPSA
29.1
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
11
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
31.84

Supplementary Information

InChIKey: KKBLTLYRVPNHON-UHFFFAOYSA-N
Synonyme
5-(trifluoromethyl)-5-methylpyrrolidin-2-oneSCHEMBL9125962
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