(2E)-N-[4-(1-Benzoyl-4-piperidinyl)butyl]-3-(3-pyridinyl)-2-propenamide

C₂₄H₂₉N₃O₂CAS 658084-64-1391.52 g/mol

Open in Covalent MOL file

Alcohol Amide

Properties

Molecular formula: C₂₄H₂₉N₃O₂
Molar mass: 391.52 g/mol
Exact mass: 391.2260 Da
logP: 4.77Crippen estimate
Polar surface area: 65.8 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 8

Identifiers

CAS number

658084-64-1

SMILES

O=C(c1ccccc1)N1CCC(CCCCN=C(O)/C=C/c2cccnc2)CC1

InChIKey

KPBNHDGDUADAGP-VAWYXSNFSA-N

InChI

InChI=1S/C24H29N3O2/c28-23(12-11-21-8-6-15-25-19-21)26-16-5-4-7-20-13-17-27(18-14-20)24(29)22-9-2-1-3-10-22/h1-3,6,8-12,15,19-20H,4-5,7,13-14,16-18H2,(H,26,28)/b12-11+

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

Names and synonyms

4 names

2-Propenamide, N-[4-(1-benzoyl-4-piperidinyl)butyl]-3-(3-pyridinyl)-, (2E)-
FK 866
K 22.175
APO 866

Work with (2E)-N-[4-(1-Benzoyl-4-piperidinyl)butyl]-3-(3-pyridinyl)-2-propenamide

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

Elsewhere

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