Cas no 61349-99-3 (2-Pyridinecarboxamide, N-(4-nitrophenyl)-)
61349-99-3 structure
Product Name:2-Pyridinecarboxamide, N-(4-nitrophenyl)-
CAS No:61349-99-3
MF:C12H9N3O3
MW:243.218162298203
CID:482960
PubChem ID:15414088
Update Time:2025-04-19
2-Pyridinecarboxamide, N-(4-nitrophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Pyridinecarboxamide, N-(4-nitrophenyl)-
- N-(4-nitrophenyl)pyridine-2-carboxamide
- 61349-99-3
- AKOS003020234
- DTXSID50572540
- SCHEMBL16592576
-
- Inchi： 1S/C12H9N3O3/c16-12(11-3-1-2-8-13-11)14-9-4-6-10(7-5-9)15(17)18/h1-8H,(H,14,16)
- InChI Key： VGNWOZHANVNVGF-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC=CN=1)NC1C=CC(=CC=1)[N+](=O)[O-]
Computed Properties
- Exact Mass: 243.06447
- Monoisotopic Mass: 243.06439116g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 308
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.8
- Topological Polar Surface Area: 87.8?2
Experimental Properties
- PSA: 85.13
2-Pyridinecarboxamide, N-(4-nitrophenyl)- Related Literature
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
61349-99-3 (2-Pyridinecarboxamide, N-(4-nitrophenyl)-) Related Products
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
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