1-(2-Ethoxy-ethyl)-2-piperidin-4-yl-1H-benzimidazole

C₁₆H₂₃N₃OCAS 110963-63-8273.38 g/mol

Open in Covalent MOL file

Ether Secondary amine

Properties

Molecular formula: C₁₆H₂₃N₃O
Molar mass: 273.38 g/mol
Exact mass: 273.1841 Da
logP: 2.54Crippen estimate
Polar surface area: 39.1 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 5

Identifiers

CAS number

110963-63-8

SMILES

CCOCCN1C2=CC=CC=C2N=C1C3CCNCC3

InChIKey

YBJXRWANRTYCJE-UHFFFAOYSA-N

InChI

InChI=1S/C16H23N3O/c1-2-20-12-11-19-15-6-4-3-5-14(15)18-16(19)13-7-9-17-10-8-13/h3-6,13,17H,2,7-12H2,1H3

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Names and synonyms

1 names

1-(2-Ethoxyethyl)-2-(piperidin-4-yl)-1H-benzo[d]imidazole

Work with 1-(2-Ethoxy-ethyl)-2-piperidin-4-yl-1H-benzimidazole

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

Bilastine202189-78-451 % similar Emedastine87233-61-247 % similar 1,3-Dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one20662-53-739 % similar Emedastine difumarate87233-62-339 % similar 1-Ethyl-2-methyl-1H-benzimidazole5805-76-536 % similar 2-(4-Piperidinyl)-1H-benzimidazole38385-95-436 % similar 4-Phenylpiperidine771-99-332 % similar 2-(Difluoromethyl)-1-(4,6-di-4-morpholinyl-1,3,5-triazin-2-yl)-1H-benzimidazole475110-96-432 % similar

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

Elsewhere

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