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

C₁₀H₁₁F₂NCAS 1218935-59-1183.20 g/mol

Open in Covalent MOL file

Aryl halide Secondary amine

Properties

Molecular formula: C₁₀H₁₁F₂N
Molar mass: 183.20 g/mol
Exact mass: 183.0860 Da
logP: 2.39Crippen estimate
Polar surface area: 12.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

1218935-59-1

SMILES

C1C[C@@H](NC1)C2=C(C=CC(=C2)F)F

InChIKey

NCXSNNVYILYEBC-SNVBAGLBSA-N

InChI

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

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Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

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

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

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

(R)-2-(2,5-Difluorophenyl)pyrrolidine hydrochloride1218935-60-491 % similar 2-(4-Fluorophenyl)pyrrolidine72216-06-957 % similar 2-(3-Fluorophenyl)pyrrolidine298690-72-957 % similar (2S)-2-(3-Fluorophenyl)pyrrolidine920274-04-057 % similar 2-(2-Chlorophenyl)pyrrolidine129540-21-246 % similar 2-(2-Bromophenyl)pyrrolidine129540-24-544 % similar 2-(2-Methylphenyl)pyrrolidine129540-23-443 % similar 2-(Naphthalen-1-yl)pyrrolidine121193-91-741 % similar

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

Elsewhere

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