chempirical

tert-Butyl 4-(6-((4-cyano-2-fluorobenzyl)oxy)pyridin-2-yl)piperidine-1-carboxylate

C23H26FN3O3CAS 2230200-28-7411.48 g/mol

Open in Covalent MOL file
OONNONF
Aryl halideCarbamateEtherNitrile

Properties

Molecular formula
C23H26FN3O3
Molar mass
411.48 g/mol
Exact mass
411.1958 Da
logP
4.79Crippen estimate
Polar surface area
75.4 Ų
H-bond donors / acceptors
0 / 5
Rotatable bonds
4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
2230200-28-7
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CC=C2)OCC3=C(C=C(C=C3)C#N)F
InChIKey
KZSAHPSOMKFNPN-UHFFFAOYSA-N
InChI
InChI=1S/C23H26FN3O3/c1-23(2,3)30-22(28)27-11-9-17(10-12-27)20-5-4-6-21(26-20)29-15-18-8-7-16(14-25)13-19(18)24/h4-8,13,17H,9-12,15H2,1-3H3

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Work with tert-Butyl 4-(6-((4-cyano-2-fluorobenzyl)oxy)pyridin-2-yl)piperidine-1-carboxylate

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Similar compounds

2-[[4-[6-[(4-Cyano-2-fluorophenyl)methoxy]-2-pyridinyl]-1-piperidinyl]methyl]-1-[(2S)-2-oxetanylmethyl]-1H-benzimidazole-6-carboxylic acid2230198-02-251 % similar 1-N-Boc-4-(phenylamino)piperidine125541-22-239 % similar 4-P-Aminophenyl-1-boc-piperidine170011-57-139 % similar tert-Butyl 4-cyanopiperidine-1-carboxylate91419-52-238 % similar tert-Butyl 4-(6-aminopyridin-3-yl)piperidine-1-carboxylate1198408-35-338 % similar 1-(1,1-Dimethylethyl) 4-(4-carboxyphenyl)-1-piperidinecarboxylate149353-75-337 % similar 1-Boc-4-(4-fluoro-phenylamino)-piperidine288573-56-837 % similar tert-Butyl 4-((pyridin-4-ylmethyl)amino)piperidine-1-carboxylate206274-24-037 % similar

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

Elsewhere

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