(R)-2-(2,5-Difluorophenyl)pyrrolidine hydrochloride

C₁₀H₁₂ClF₂NCAS 1218935-60-4219.66 g/mol

Open in Covalent MOL file

Aryl halide Secondary amine

Properties

Molecular formula: C₁₀H₁₂ClF₂N
Molar mass: 219.66 g/mol
Exact mass: 219.0626 Da
logP: 2.81Crippen estimate
Polar surface area: 12.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

1218935-60-4

SMILES

Cl.Fc1ccc(F)c([C@H]2CCCN2)c1

InChIKey

XSWCQOVADZHFIJ-HNCPQSOCSA-N

InChI

InChI=1S/C10H11F2N.ClH/c11-7-3-4-9(12)8(6-7)10-2-1-5-13-10;/h3-4,6,10,13H,1-2,5H2;1H/t10-;/m1./s1

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Names and synonyms

1 names

Pyrrolidine, 2-(2,5-difluorophenyl)-, hydrochloride (1:1), (2R)-

Work with (R)-2-(2,5-Difluorophenyl)pyrrolidine hydrochloride

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

(2R)-2-(2,5-Difluorophenyl)pyrrolidine1218935-59-191 % similar 2-(4-Fluorophenyl)pyrrolidine72216-06-953 % similar 2-(3-Fluorophenyl)pyrrolidine298690-72-953 % similar (2S)-2-(3-Fluorophenyl)pyrrolidine920274-04-053 % similar 2,5-Difluorophenylhydrazine monohydrochloride175135-73-641 % similar 2-(2-Bromophenyl)pyrrolidine129540-24-540 % similar (2,4-Difluorophenyl)(piperidin-4-yl)methanone hydrochloride106266-04-040 % similar 2-(Naphthalen-1-yl)pyrrolidine121193-91-739 % similar

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

Elsewhere

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