2-(2-Bromophenyl)pyrrolidine

C₁₀H₁₂BrNCAS 129540-24-5226.12 g/mol

Open in Covalent MOL file

Aryl halide Secondary amine

Properties

Molecular formula: C₁₀H₁₂BrN
Molar mass: 226.12 g/mol
Exact mass: 225.0153 Da
logP: 2.87Crippen estimate
Polar surface area: 12.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Identifiers

CAS number

129540-24-5

SMILES

Brc1ccccc1C1CCCN1

InChIKey

BSLGMIVYENBFFY-UHFFFAOYSA-N

InChI

InChI=1S/C10H12BrN/c11-9-5-2-1-4-8(9)10-6-3-7-12-10/h1-2,4-5,10,12H,3,6-7H2

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Names and synonyms

1 names

Pyrrolidine, 2-(2-bromophenyl)-

Work with 2-(2-Bromophenyl)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

2-(2-Chlorophenyl)pyrrolidine129540-21-261 % similar 2-(2-Methylphenyl)pyrrolidine129540-23-461 % similar 2-(Naphthalen-1-yl)pyrrolidine121193-91-759 % similar 2-Phenylpyrrolidine1006-64-055 % similar 2-(2-Pyrrolidinyl)pyridine77790-61-551 % similar 2-Phenylpiperidine3466-80-648 % similar (2R)-2-(2,5-Difluorophenyl)pyrrolidine1218935-59-144 % similar 4-(Pyrrolidin-2-yl)pyridine128562-25-443 % similar

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

Elsewhere

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