1-(2-Amino-6-methylpyrimidin-4-yl)-N,N-dimethylpiperidin-4-aminium chloride

1-(2-Amino-6-methylpyrimidin-4-yl)-N,N-dimethylpiperidin-4-aminium chloride

In the title molecular salt, C12H22N5+·Cl−, the cation is protonated at the dimethyl-substituted tertiary N atom. The piperidine ring adopts a chair conformation with the exocyclic N—C bond in an equatorial orientation. The dihedral angle between the piperidi...

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Main Authors: S. Sreenivasa, K.E. ManojKumar, P.A. Suchetan, T. Srinivasan, B. S. Palakshamurthy, D. Velmurgan
Format: Article
Language:English
Published: International Union of Crystallography 2012-12-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536812046533
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spelling doaj-9ceb5cd7ec204ba0adc430180cee9c192020-11-25T01:52:48ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682012-12-016812o3371o337110.1107/S16005368120465331-(2-Amino-6-methylpyrimidin-4-yl)-N,N-dimethylpiperidin-4-aminium chlorideS. SreenivasaK.E. ManojKumarP.A. SuchetanT. SrinivasanB. S. PalakshamurthyD. VelmurganIn the title molecular salt, C12H22N5+·Cl−, the cation is protonated at the dimethyl-substituted tertiary N atom. The piperidine ring adopts a chair conformation with the exocyclic N—C bond in an equatorial orientation. The dihedral angle between the piperidine ring (all atoms) and the pyrimidine ring is 14.00 (1)°. In the crystal, the ions are connected by N—H...N hydrogen bonds, forming inversion dimers, which are further connected by N—H...Cl hydrogen bonds. Aromatic π–π stacking interactions [centroid–centroid separation = 3.4790 (9) Å] are also observed in the structure.http://scripts.iucr.org/cgi-bin/paper?S1600536812046533
collection DOAJ
language English
format Article
sources DOAJ
author S. Sreenivasa
K.E. ManojKumar
P.A. Suchetan
T. Srinivasan
B. S. Palakshamurthy
D. Velmurgan
spellingShingle S. Sreenivasa
K.E. ManojKumar
P.A. Suchetan
T. Srinivasan
B. S. Palakshamurthy
D. Velmurgan
1-(2-Amino-6-methylpyrimidin-4-yl)-N,N-dimethylpiperidin-4-aminium chloride
Acta Crystallographica Section E
author_facet S. Sreenivasa
K.E. ManojKumar
P.A. Suchetan
T. Srinivasan
B. S. Palakshamurthy
D. Velmurgan
author_sort S. Sreenivasa
title 1-(2-Amino-6-methylpyrimidin-4-yl)-N,N-dimethylpiperidin-4-aminium chloride
title_short 1-(2-Amino-6-methylpyrimidin-4-yl)-N,N-dimethylpiperidin-4-aminium chloride
title_full 1-(2-Amino-6-methylpyrimidin-4-yl)-N,N-dimethylpiperidin-4-aminium chloride
title_fullStr 1-(2-Amino-6-methylpyrimidin-4-yl)-N,N-dimethylpiperidin-4-aminium chloride
title_full_unstemmed 1-(2-Amino-6-methylpyrimidin-4-yl)-N,N-dimethylpiperidin-4-aminium chloride
title_sort 1-(2-amino-6-methylpyrimidin-4-yl)-n,n-dimethylpiperidin-4-aminium chloride
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2012-12-01
description In the title molecular salt, C12H22N5+·Cl−, the cation is protonated at the dimethyl-substituted tertiary N atom. The piperidine ring adopts a chair conformation with the exocyclic N—C bond in an equatorial orientation. The dihedral angle between the piperidine ring (all atoms) and the pyrimidine ring is 14.00 (1)°. In the crystal, the ions are connected by N—H...N hydrogen bonds, forming inversion dimers, which are further connected by N—H...Cl hydrogen bonds. Aromatic π–π stacking interactions [centroid–centroid separation = 3.4790 (9) Å] are also observed in the structure.
url http://scripts.iucr.org/cgi-bin/paper?S1600536812046533
work_keys_str_mv AT ssreenivasa 12amino6methylpyrimidin4ylnndimethylpiperidin4aminiumchloride
AT kemanojkumar 12amino6methylpyrimidin4ylnndimethylpiperidin4aminiumchloride
AT pasuchetan 12amino6methylpyrimidin4ylnndimethylpiperidin4aminiumchloride
AT tsrinivasan 12amino6methylpyrimidin4ylnndimethylpiperidin4aminiumchloride
AT bspalakshamurthy 12amino6methylpyrimidin4ylnndimethylpiperidin4aminiumchloride
AT dvelmurgan 12amino6methylpyrimidin4ylnndimethylpiperidin4aminiumchloride
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