2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide

C70H50Cl3F3N22O6 — CID 158254129

IUPAC2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide
SMILESCc1nc(NC(=O)c2ccc(-c3ccccn3)cc2)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc(C(F)(F)F)cc2Cl)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccccc2Cl)nc(-c2ccccn2)n1
InChIInChI=1S/C21H16N6O.C17H11ClF3N5O.C16H11ClN6O3.C16H12ClN5O/c1-14-24-19(18-7-3-5-13-23-18)26-21(25-14)27-20(28)16-10-8-15(9-11-16)17-6-2-4-12-22-17;1-9-23-14(13-4-2-3-7-22-13)25-16(24-9)26-15(27)11-6-5-10(8-12(11)18)17(19,20)21;1-9-19-14(13-4-2-3-7-18-13)21-16(20-9)22-15(24)11-6-5-10(23(25)26)8-12(11)17;1-10-19-14(13-8-4-5-9-18-13)21-16(20-10)22-15(23)11-6-2-3-7-12(11)17/h2-13H,1H3,(H,24,25,26,27,28);2-8H,1H3,(H,23,24,25,26,27);2-8H,1H3,(H,19,20,21,22,24);2-9H,1H3,(H,19,20,21,22,23)
InChIKeyGHBLKRHFCINAMO-UHFFFAOYSA-N
MW1458.67 g/mol
LogP13.93
Rot. Bonds14

About 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide

2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide (PubChem CID 158254129) has the molecular formula C70H50Cl3F3N22O6 and a molecular weight of 1458.67 g/mol. Its IUPAC name is 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide.

Molecular Properties

Compound Name2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide
PubChem CID158254129
Molecular FormulaC70H50Cl3F3N22O6
Molecular Weight1458.67 g/mol
Exact Mass1456.33
IUPAC Name2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide
SMILESCc1nc(NC(=O)c2ccc(-c3ccccn3)cc2)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc(C(F)(F)F)cc2Cl)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccccc2Cl)nc(-c2ccccn2)n1
InChIInChI=1S/C21H16N6O.C17H11ClF3N5O.C16H11ClN6O3.C16H12ClN5O/c1-14-24-19(18-7-3-5-13-23-18)26-21(25-14)27-20(28)16-10-8-15(9-11-16)17-6-2-4-12-22-17;1-9-23-14(13-4-2-3-7-22-13)25-16(24-9)26-15(27)11-6-5-10(8-12(11)18)17(19,20)21;1-9-19-14(13-4-2-3-7-18-13)21-16(20-9)22-15(24)11-6-5-10(23(25)26)8-12(11)17;1-10-19-14(13-8-4-5-9-18-13)21-16(20-10)22-15(23)11-6-2-3-7-12(11)17/h2-13H,1H3,(H,24,25,26,27,28);2-8H,1H3,(H,23,24,25,26,27);2-8H,1H3,(H,19,20,21,22,24);2-9H,1H3,(H,19,20,21,22,23)
InChIKeyGHBLKRHFCINAMO-UHFFFAOYSA-N
XLogP13.93
TPSA378.67 Ų
H-Bond Donors4
H-Bond Acceptors23
Rotatable Bonds14
Heavy Atoms104
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001458.67
LogP ≤ 513.93
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide with MolForge

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Related Compounds

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2-chloro-4-nitro-N-[4-(trifluoromethyl)phenyl]benzamide
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N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-sulfamoylbenzamide
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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide?
The IUPAC name of 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide (CID 158254129) is 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide.
What is the SMILES notation for 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide?
The canonical SMILES for 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide is Cc1nc(NC(=O)c2ccc(-c3ccccn3)cc2)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc(C(F)(F)F)cc2Cl)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccccc2Cl)nc(-c2ccccn2)n1.
What is the InChIKey of 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide?
The InChIKey is GHBLKRHFCINAMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N6O.C17H11ClF3N5O.C16H11ClN6O3.C16H12ClN5O/c1-14-24-19(18-7-3-5-13-23-18)26-21(25-14)27-20(28)16-10-8-15(9-11-16)17-6-2-4-12-22-17;1-9-23-14(13-4-2-3-7-22-13)25-16(24-9)26-15(27)11-6-5-10(8-12(11)18)17(19,20)21;1-9-19-14(13-4-2-3-7-18-13)21-16(20-9)22-15(24)11-6-5-10(23(25)26)8-12(11)17;1-10-19-14(13-8-4-5-9-18-13)21-16(20-10)22-15(23)11-6-2-3-7-12(11)17/h2-13H,1H3,(H,24,25,26,27,28);2-8H,1H3,(H,23,24,25,26,27);2-8H,1H3,(H,19,20,21,22,24);2-9H,1H3,(H,19,20,21,22,23).
What are the key properties of 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide?
2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide has a molecular weight of 1458.67 g/mol, XLogP of 13.93, 14 rotatable bonds, 4 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)benzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-nitrobenzamide;2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)benzamide;N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-4-pyridin-2-ylbenzamide is sourced from PubChem (CID 158254129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).