Literature DB >> 25186363

Halogenated C,N-diarylacetamides: molecular conformations and supramolecular assembly.

Prakash S Nayak1, Jerry P Jasinski2, James A Golen2, Badiadka Narayana1, Manpreet Kaur3, Hemmige S Yathirajan3, Christopher Glidewell4.   

Abstract

The structures of four halogenated N,2-diarylacetamides are reported and compared with a range of analogues. N-(4-Chloro-3-methylphenyl)-2-phenylacetamide, C(15)H(14)ClNO, (I), and N-(4-bromo-3-methylphenyl)-2-phenylacetamide, C(15)H(14)BrNO, (II), are isostructural in the space group P-1. The molecules of (I) and (II) are linked into chains of rings by a combination of N-H...O and C-H...π(arene) hydrogen bonds. The molecules of N-(4-chloro-3-methylphenyl)-2-(2,4-dichlorophenyl)acetamide, C(15)H(12)Cl(3)NO, (III), and N-(4-bromo-3-methylphenyl)-2-(2-chlorophenyl)acetamide, C(15)H(13)BrClNO, (IV), are linked into simple C(4) chains by N-H...O hydrogen bonds, but significant C-H...π(arene) interactions are absent. The N-aryl groups in compounds (III) and (IV) adopt a different orientation, by ca 180°, from that of the corresponding groups in compounds (I) and (II), but otherwise the conformations of (I)-(IV) are very similar. Comparisons are drawn between compounds (I) and (IV) and a range of analogues of the type R(1)CH(2)CONHR(2), where R(2) represents a halogenated aryl ring and R(1) represents either another halogenated aryl ring or a naphthalen-1-yl unit.

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Keywords:  C,N-diarylacetamides; acetamides; benzyl penicillins; crystal structure; hydrogen bonding; molecular conformation; supramolecular assembly

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Year:  2014        PMID: 25186363     DOI: 10.1107/S2053229614018713

Source DB:  PubMed          Journal:  Acta Crystallogr C Struct Chem        ISSN: 2053-2296            Impact factor:   1.172


  1 in total

1.  Crystal structures of two C,N-disubstituted acetamides: 2-(4-chloro-phen-yl)-N-(2-iodo-phen-yl)acetamide and 2-(4-chloro-phen-yl)-N-(pyrazin-2-yl)acetamide.

Authors:  Badiadka Narayana; Hemmige S Yathirajan; Ravindranath Rathore; Christopher Glidewell
Journal:  Acta Crystallogr E Crystallogr Commun       Date:  2016-08-09
  1 in total

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