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2,4-Bis(2-methyl­phen­yl)-3-aza­bicyclo[3.3.1]nonan-9-one O-methyl­oxime

The mol­ecule of the title compound, C(23)H(28)N(2)O, exists in a twin-chair conformation, with equatorial orientation of the ortho-tolyl groups on both sides of the secondary amino group. The title oxime compound and its ketone precursor 2,4-bis­(2-methyl­phen­yl)-3-aza­bicyclo­[3.3.1]nonan-9-one e...

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Detalles Bibliográficos
Autores principales: Parthiban, P., Ramkumar, V., Jeong, Yeon Tae
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3009131/
https://www.ncbi.nlm.nih.gov/pubmed/21589144
http://dx.doi.org/10.1107/S1600536810043436
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author Parthiban, P.
Ramkumar, V.
Jeong, Yeon Tae
author_facet Parthiban, P.
Ramkumar, V.
Jeong, Yeon Tae
author_sort Parthiban, P.
collection PubMed
description The mol­ecule of the title compound, C(23)H(28)N(2)O, exists in a twin-chair conformation, with equatorial orientation of the ortho-tolyl groups on both sides of the secondary amino group. The title oxime compound and its ketone precursor 2,4-bis­(2-methyl­phen­yl)-3-aza­bicyclo­[3.3.1]nonan-9-one exhibit similar stereochemistries, with the orientation of the o-tolyl rings almost identical in both compounds. In the title compound, the tolyl rings are at an angle of 23.77 (3)° with respect to one another; the angle in the precursor is 29.4 (1)° [Vijayalakshmi, Parthasarathi, Venkatraj & Jeyaraman (2000 ▶), Acta Cryst. C56, 1240–1241]. The cyclo­hexane ring and the oxime ether are disordered over two alternative orientations, with a refined site-occupancy ratio of 0.813 (2):0.186 (4). The crystal structure of the title compound is stabilized by inter­molecular N—H⋯π inter­actions.
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spelling pubmed-30091312010-12-30 2,4-Bis(2-methyl­phen­yl)-3-aza­bicyclo[3.3.1]nonan-9-one O-methyl­oxime Parthiban, P. Ramkumar, V. Jeong, Yeon Tae Acta Crystallogr Sect E Struct Rep Online Organic Papers The mol­ecule of the title compound, C(23)H(28)N(2)O, exists in a twin-chair conformation, with equatorial orientation of the ortho-tolyl groups on both sides of the secondary amino group. The title oxime compound and its ketone precursor 2,4-bis­(2-methyl­phen­yl)-3-aza­bicyclo­[3.3.1]nonan-9-one exhibit similar stereochemistries, with the orientation of the o-tolyl rings almost identical in both compounds. In the title compound, the tolyl rings are at an angle of 23.77 (3)° with respect to one another; the angle in the precursor is 29.4 (1)° [Vijayalakshmi, Parthasarathi, Venkatraj & Jeyaraman (2000 ▶), Acta Cryst. C56, 1240–1241]. The cyclo­hexane ring and the oxime ether are disordered over two alternative orientations, with a refined site-occupancy ratio of 0.813 (2):0.186 (4). The crystal structure of the title compound is stabilized by inter­molecular N—H⋯π inter­actions. International Union of Crystallography 2010-10-30 /pmc/articles/PMC3009131/ /pubmed/21589144 http://dx.doi.org/10.1107/S1600536810043436 Text en © Parthiban et al. 2010 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Organic Papers
Parthiban, P.
Ramkumar, V.
Jeong, Yeon Tae
2,4-Bis(2-methyl­phen­yl)-3-aza­bicyclo[3.3.1]nonan-9-one O-methyl­oxime
title 2,4-Bis(2-methyl­phen­yl)-3-aza­bicyclo[3.3.1]nonan-9-one O-methyl­oxime
title_full 2,4-Bis(2-methyl­phen­yl)-3-aza­bicyclo[3.3.1]nonan-9-one O-methyl­oxime
title_fullStr 2,4-Bis(2-methyl­phen­yl)-3-aza­bicyclo[3.3.1]nonan-9-one O-methyl­oxime
title_full_unstemmed 2,4-Bis(2-methyl­phen­yl)-3-aza­bicyclo[3.3.1]nonan-9-one O-methyl­oxime
title_short 2,4-Bis(2-methyl­phen­yl)-3-aza­bicyclo[3.3.1]nonan-9-one O-methyl­oxime
title_sort 2,4-bis(2-methyl­phen­yl)-3-aza­bicyclo[3.3.1]nonan-9-one o-methyl­oxime
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3009131/
https://www.ncbi.nlm.nih.gov/pubmed/21589144
http://dx.doi.org/10.1107/S1600536810043436
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