3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide;6-methyl-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]pyridine-2-carboxamide;6-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)pyridine-2-carboxamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide

C70H52F6N18O8 — CID 123423492

About 3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide;6-methyl-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]pyridine-2-carboxamide;6-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)pyridine-2-carboxamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide

3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide;6-methyl-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]pyridine-2-carboxamide;6-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)pyridine-2-carboxamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide (PubChem CID 123423492) has the molecular formula C70H52F6N18O8 and a molecular weight of 1387.29 g/mol. Its IUPAC name is 3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide;6-methyl-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]pyridine-2-carboxamide;6-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)pyridine-2-carboxamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide.

Molecular Properties

• Compound Name: 3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide;6-methyl-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]pyridine-2-carboxamide;6-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)pyridine-2-carboxamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide
• PubChem CID: 123423492
• Molecular Formula: C70H52F6N18O8
• Molecular Weight: 1387.29 g/mol
• Exact Mass: 1386.41
• IUPAC Name: 3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide;6-methyl-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]pyridine-2-carboxamide;6-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)pyridine-2-carboxamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide
• SMILES: C#Cc1cccc(C(=O)Nc2cncc(Oc3ccc(C(F)(F)F)nc3)n2)c1.Cc1ccc(Oc2cncc(NC(=O)c3cccc(C)n3)n2)cn1.Cc1cccc(C(=O)Nc2cncc(Oc3ccc(C(F)(F)F)nc3)n2)c1.Cc1cccc(C(=O)Nc2cncc(Oc3cccnc3)n2)n1
• InChI: InChI=1S/C19H11F3N4O2.C18H13F3N4O2.C17H15N5O2.C16H13N5O2/c1-2-12-4-3-5-13(8-12)18(27)26-16-10-23-11-17(25-16)28-14-6-7-15(24-9-14)19(20,21)22;1-11-3-2-4-12(7-11)17(26)25-15-9-22-10-16(24-15)27-13-5-6-14(23-8-13)18(19,20)21;1-11-6-7-13(8-19-11)24-16-10-18-9-15(21-16)22-17(23)14-5-3-4-12(2)20-14;1-11-4-2-6-13(19-11)16(22)21-14-9-18-10-15(20-14)23-12-5-3-7-17-8-12/h1,3-11H,(H,25,26,27);2-10H,1H3,(H,24,25,26);3-10H,1-2H3,(H,21,22,23);2-10H,1H3,(H,20,21,22)
• InChIKey: WPVRFSGJFNOYOR-UHFFFAOYSA-N
• XLogP: 13.71
• TPSA: 333.78 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 22
• Rotatable Bonds: 16
• Heavy Atoms: 102
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1387.29
LogP ≤ 5	13.71
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide;6-methyl-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]pyridine-2-carboxamide;6-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)pyridine-2-carboxamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide?

The IUPAC name of 3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide;6-methyl-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]pyridine-2-carboxamide;6-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)pyridine-2-carboxamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide (CID 123423492) is 3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide;6-methyl-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]pyridine-2-carboxamide;6-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)pyridine-2-carboxamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide.

What is the SMILES notation for 3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide;6-methyl-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]pyridine-2-carboxamide;6-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)pyridine-2-carboxamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide?

The canonical SMILES for 3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide;6-methyl-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]pyridine-2-carboxamide;6-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)pyridine-2-carboxamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide is C#Cc1cccc(C(=O)Nc2cncc(Oc3ccc(C(F)(F)F)nc3)n2)c1.Cc1ccc(Oc2cncc(NC(=O)c3cccc(C)n3)n2)cn1.Cc1cccc(C(=O)Nc2cncc(Oc3ccc(C(F)(F)F)nc3)n2)c1.Cc1cccc(C(=O)Nc2cncc(Oc3cccnc3)n2)n1.

What is the InChIKey of 3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide;6-methyl-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]pyridine-2-carboxamide;6-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)pyridine-2-carboxamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide?

The InChIKey is WPVRFSGJFNOYOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11F3N4O2.C18H13F3N4O2.C17H15N5O2.C16H13N5O2/c1-2-12-4-3-5-13(8-12)18(27)26-16-10-23-11-17(25-16)28-14-6-7-15(24-9-14)19(20,21)22;1-11-3-2-4-12(7-11)17(26)25-15-9-22-10-16(24-15)27-13-5-6-14(23-8-13)18(19,20)21;1-11-6-7-13(8-19-11)24-16-10-18-9-15(21-16)22-17(23)14-5-3-4-12(2)20-14;1-11-4-2-6-13(19-11)16(22)21-14-9-18-10-15(20-14)23-12-5-3-7-17-8-12/h1,3-11H,(H,25,26,27);2-10H,1H3,(H,24,25,26);3-10H,1-2H3,(H,21,22,23);2-10H,1H3,(H,20,21,22).

What are the key properties of 3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide;6-methyl-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]pyridine-2-carboxamide;6-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)pyridine-2-carboxamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide?

3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide;6-methyl-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]pyridine-2-carboxamide;6-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)pyridine-2-carboxamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide has a molecular weight of 1387.29 g/mol, XLogP of 13.71, 16 rotatable bonds, 4 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide;6-methyl-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]pyridine-2-carboxamide;6-methyl-N-(6-pyridin-3-yloxypyrazin-2-yl)pyridine-2-carboxamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide is sourced from PubChem (CID 123423492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).