4-Amino-6-(piperidin-1-yl)pyrimidine-5-carbo­nitrile

In the title compound, C(10)H(13)N(5), the piperidine ring adopts a chair conformation with the exocyclic N—C bond in an axial orientation, and the dihedral angle between the mean planes of piperidine and pyrimidine rings is 49.57 (11)°. A short intra­molecular C—H⋯N contact generates an S(7) ring....

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Detalles Bibliográficos
Autores principales: Bhat, Radhika, Shraddha, K. N., Begum, Noor Shahina
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2020
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462203/
https://www.ncbi.nlm.nih.gov/pubmed/36339485
http://dx.doi.org/10.1107/S2414314620003855
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author Bhat, Radhika
Shraddha, K. N.
Begum, Noor Shahina
author_facet Bhat, Radhika
Shraddha, K. N.
Begum, Noor Shahina
author_sort Bhat, Radhika
collection PubMed
description In the title compound, C(10)H(13)N(5), the piperidine ring adopts a chair conformation with the exocyclic N—C bond in an axial orientation, and the dihedral angle between the mean planes of piperidine and pyrimidine rings is 49.57 (11)°. A short intra­molecular C—H⋯N contact generates an S(7) ring. In the crystal, N—H⋯N hydrogen bonds link the mol­ecules into (100) sheets and a weak aromatic π-π stacking inter­action is observed [centroid–centroid separation = 3.5559 (11) Å] between inversion-related pyrimidine rings. [Image: see text]
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spelling pubmed-94622032022-11-04 4-Amino-6-(piperidin-1-yl)pyrimidine-5-carbo­nitrile Bhat, Radhika Shraddha, K. N. Begum, Noor Shahina IUCrdata Data Reports In the title compound, C(10)H(13)N(5), the piperidine ring adopts a chair conformation with the exocyclic N—C bond in an axial orientation, and the dihedral angle between the mean planes of piperidine and pyrimidine rings is 49.57 (11)°. A short intra­molecular C—H⋯N contact generates an S(7) ring. In the crystal, N—H⋯N hydrogen bonds link the mol­ecules into (100) sheets and a weak aromatic π-π stacking inter­action is observed [centroid–centroid separation = 3.5559 (11) Å] between inversion-related pyrimidine rings. [Image: see text] International Union of Crystallography 2020-03-17 /pmc/articles/PMC9462203/ /pubmed/36339485 http://dx.doi.org/10.1107/S2414314620003855 Text en © Bhat et al. 2020 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 Data Reports
Bhat, Radhika
Shraddha, K. N.
Begum, Noor Shahina
4-Amino-6-(piperidin-1-yl)pyrimidine-5-carbo­nitrile
title 4-Amino-6-(piperidin-1-yl)pyrimidine-5-carbo­nitrile
title_full 4-Amino-6-(piperidin-1-yl)pyrimidine-5-carbo­nitrile
title_fullStr 4-Amino-6-(piperidin-1-yl)pyrimidine-5-carbo­nitrile
title_full_unstemmed 4-Amino-6-(piperidin-1-yl)pyrimidine-5-carbo­nitrile
title_short 4-Amino-6-(piperidin-1-yl)pyrimidine-5-carbo­nitrile
title_sort 4-amino-6-(piperidin-1-yl)pyrimidine-5-carbo­nitrile
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462203/
https://www.ncbi.nlm.nih.gov/pubmed/36339485
http://dx.doi.org/10.1107/S2414314620003855
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