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Crystal structure and Hirshfeld surface analysis of 2-amino-4-(4-meth­oxy­phen­yl)-6-oxo-1-phenyl-1,4,5,6-tetra­hydro­pyridine-3-carbo­nitrile

The central tetra­hydro­pyridine ring of the title compound, C(19)H(17)N(3)O(2), adopts a screw-boat conformation. In the crystal, strong C—H⋯O and N—H⋯N hydrogen bonds form dimers with R (2) (2)(14) and R (2) (2)(12) ring motifs, respectively, between consecutive mol­ecules along the c-axis directi...

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Autores principales: Asadov, Khammed A., Khrustalev, Victor N., Dobrokhotova, Ekaterina V., Akkurt, Mehmet, Huseynova, Afet T., Akobirshoeva, Anzurat A., Huseynov, Elnur Z.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8900505/
https://www.ncbi.nlm.nih.gov/pubmed/35371539
http://dx.doi.org/10.1107/S205698902200175X
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author Asadov, Khammed A.
Khrustalev, Victor N.
Dobrokhotova, Ekaterina V.
Akkurt, Mehmet
Huseynova, Afet T.
Akobirshoeva, Anzurat A.
Huseynov, Elnur Z.
author_facet Asadov, Khammed A.
Khrustalev, Victor N.
Dobrokhotova, Ekaterina V.
Akkurt, Mehmet
Huseynova, Afet T.
Akobirshoeva, Anzurat A.
Huseynov, Elnur Z.
author_sort Asadov, Khammed A.
collection PubMed
description The central tetra­hydro­pyridine ring of the title compound, C(19)H(17)N(3)O(2), adopts a screw-boat conformation. In the crystal, strong C—H⋯O and N—H⋯N hydrogen bonds form dimers with R (2) (2)(14) and R (2) (2)(12) ring motifs, respectively, between consecutive mol­ecules along the c-axis direction. Inter­molecular N—H⋯O and C—H⋯O hydrogen bonds connect these dimers, forming a three-dimensional network. C—H⋯π inter­actions and π–π stacking inter­actions contribute to the stabilization of the mol­ecular packing. A Hirshfeld surface analysis indicates that the contributions from the most prevalent inter­actions are H⋯H (47.1%), C⋯H/H⋯C (20.9%), O⋯H/H⋯O (15.3%) and N⋯H/H⋯N (11.4%).
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spelling pubmed-89005052022-03-31 Crystal structure and Hirshfeld surface analysis of 2-amino-4-(4-meth­oxy­phen­yl)-6-oxo-1-phenyl-1,4,5,6-tetra­hydro­pyridine-3-carbo­nitrile Asadov, Khammed A. Khrustalev, Victor N. Dobrokhotova, Ekaterina V. Akkurt, Mehmet Huseynova, Afet T. Akobirshoeva, Anzurat A. Huseynov, Elnur Z. Acta Crystallogr E Crystallogr Commun Research Communications The central tetra­hydro­pyridine ring of the title compound, C(19)H(17)N(3)O(2), adopts a screw-boat conformation. In the crystal, strong C—H⋯O and N—H⋯N hydrogen bonds form dimers with R (2) (2)(14) and R (2) (2)(12) ring motifs, respectively, between consecutive mol­ecules along the c-axis direction. Inter­molecular N—H⋯O and C—H⋯O hydrogen bonds connect these dimers, forming a three-dimensional network. C—H⋯π inter­actions and π–π stacking inter­actions contribute to the stabilization of the mol­ecular packing. A Hirshfeld surface analysis indicates that the contributions from the most prevalent inter­actions are H⋯H (47.1%), C⋯H/H⋯C (20.9%), O⋯H/H⋯O (15.3%) and N⋯H/H⋯N (11.4%). International Union of Crystallography 2022-02-22 /pmc/articles/PMC8900505/ /pubmed/35371539 http://dx.doi.org/10.1107/S205698902200175X Text en © Asadov et al. 2022 https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Research Communications
Asadov, Khammed A.
Khrustalev, Victor N.
Dobrokhotova, Ekaterina V.
Akkurt, Mehmet
Huseynova, Afet T.
Akobirshoeva, Anzurat A.
Huseynov, Elnur Z.
Crystal structure and Hirshfeld surface analysis of 2-amino-4-(4-meth­oxy­phen­yl)-6-oxo-1-phenyl-1,4,5,6-tetra­hydro­pyridine-3-carbo­nitrile
title Crystal structure and Hirshfeld surface analysis of 2-amino-4-(4-meth­oxy­phen­yl)-6-oxo-1-phenyl-1,4,5,6-tetra­hydro­pyridine-3-carbo­nitrile
title_full Crystal structure and Hirshfeld surface analysis of 2-amino-4-(4-meth­oxy­phen­yl)-6-oxo-1-phenyl-1,4,5,6-tetra­hydro­pyridine-3-carbo­nitrile
title_fullStr Crystal structure and Hirshfeld surface analysis of 2-amino-4-(4-meth­oxy­phen­yl)-6-oxo-1-phenyl-1,4,5,6-tetra­hydro­pyridine-3-carbo­nitrile
title_full_unstemmed Crystal structure and Hirshfeld surface analysis of 2-amino-4-(4-meth­oxy­phen­yl)-6-oxo-1-phenyl-1,4,5,6-tetra­hydro­pyridine-3-carbo­nitrile
title_short Crystal structure and Hirshfeld surface analysis of 2-amino-4-(4-meth­oxy­phen­yl)-6-oxo-1-phenyl-1,4,5,6-tetra­hydro­pyridine-3-carbo­nitrile
title_sort crystal structure and hirshfeld surface analysis of 2-amino-4-(4-meth­oxy­phen­yl)-6-oxo-1-phenyl-1,4,5,6-tetra­hydro­pyridine-3-carbo­nitrile
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8900505/
https://www.ncbi.nlm.nih.gov/pubmed/35371539
http://dx.doi.org/10.1107/S205698902200175X
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