2-(3-Methoxyphenyl)pyrrolidine

C₁₁H₁₅NOCAS 103861-77-4177.25 g/mol

Open in Covalent MOL file

Ether Secondary amine

Properties

Molecular formula: C₁₁H₁₅NO
Molar mass: 177.25 g/mol
Exact mass: 177.1154 Da
logP: 2.12Crippen estimate
Polar surface area: 21.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Identifiers

CAS number

103861-77-4

SMILES

COC1=CC=CC(=C1)C2CCCN2

InChIKey

QGKFYRMABWIOIW-UHFFFAOYSA-N

InChI

InChI=1S/C11H15NO/c1-13-10-5-2-4-9(8-10)11-6-3-7-12-11/h2,4-5,8,11-12H,3,6-7H2,1H3

Weigh it out

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

Work with 2-(3-Methoxyphenyl)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-(3-Fluorophenyl)pyrrolidine298690-72-958 % similar 2-(3-Chlorophenyl)pyrrolidine298690-74-158 % similar (2S)-2-(3-Fluorophenyl)pyrrolidine920274-04-058 % similar 2-Phenylpyrrolidine1006-64-054 % similar 2-Phenylpiperidine3466-80-649 % similar 2-(3-Methoxyphenyl)cyclohexanone15547-89-448 % similar 3-Methoxy-α-methylbenzenemethanamine62409-13-648 % similar (αS)-3-Methoxy-α-methylbenzenemethanamine82796-69-848 % similar

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

Same formula

(3S)-1-(Phenylmethyl)-3-pyrrolidinol101385-90-4 (R)-(+)-1-Benzyl-3-pyrrolidinol101930-07-8 4-N-Butylbenzamide107377-07-1 4-(Diethylamino)benzaldehyde120-21-8 N,N-Diethylbenzamide1696-17-9 N-tert-Butyl-α-phenylnitrone3376-24-7 2-Amino-7-methoxytetralin4003-89-8 4-Hydroxy-4-phenylpiperidine40807-61-2

Elsewhere

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