2-(Pyrrolidin-1-yl)-5-(trifluoromethyl)aniline

C₁₁H₁₃F₃N₂CAS 133184-80-2230.23 g/mol

Open in Covalent MOL file

Alkyl halide Primary amine Tertiary amine

Properties

Molecular formula: C₁₁H₁₃F₃N₂
Molar mass: 230.23 g/mol
Exact mass: 230.1031 Da
logP: 2.89Crippen estimate
Polar surface area: 29.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

133184-80-2

SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)N

InChIKey

HPDFKXPVMXSXGE-UHFFFAOYSA-N

InChI

InChI=1S/C11H13F3N2/c12-11(13,14)8-3-4-10(9(15)7-8)16-5-1-2-6-16/h3-4,7H,1-2,5-6,15H2

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Names and synonyms

1 names

N-(2-Amino-4-trifluoromethylphenyl)pyrrolidine

Work with 2-(Pyrrolidin-1-yl)-5-(trifluoromethyl)aniline

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Iodo-5-(trifluoromethyl)aniline105202-02-649 % similar 2-Chloro-5-(trifluoromethyl)aniline121-50-649 % similar 2-Bromo-5-trifluoromethylaniline454-79-549 % similar 2-Methoxy-5-(trifluoromethyl)aniline349-65-546 % similar 2-Amino-4-(trifluoromethyl)benzonitrile1483-54-145 % similar 3-Amino-4-mercaptobenzotrifluoride hydrochloride4274-38-845 % similar 2-Chloro-4-trifluoromethylaniline39885-50-245 % similar 2-Amino-5-(trifluoromethyl)phenol454-82-045 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1-[3-(Trifluoromethyl)phenyl]piperazine15532-75-9 1-[4-(Trifluoromethyl)phenyl]piperazine30459-17-7 1-[2-(Trifluoromethyl)phenyl]piperazine63854-31-9

Elsewhere

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