5-aminopyridine-2-carbonitrile;2-bromo-5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole;2-chloro-5-(trifluoromethyl)pyrazine;N'-hydroxy-5-[[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide;bis(5-[(4-methoxyphenyl)methylamino]pyridine-2-carbonitrile);5-[(4-methoxyphenyl)methyl-[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile;5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole

C91H65BrClF15N30O8 — CID 172928081

About 5-aminopyridine-2-carbonitrile;2-bromo-5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole;2-chloro-5-(trifluoromethyl)pyrazine;N'-hydroxy-5-[[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide;bis(5-[(4-methoxyphenyl)methylamino]pyridine-2-carbonitrile);5-[(4-methoxyphenyl)methyl-[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile;5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole

5-aminopyridine-2-carbonitrile;2-bromo-5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole;2-chloro-5-(trifluoromethyl)pyrazine;N'-hydroxy-5-[[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide;bis(5-[(4-methoxyphenyl)methylamino]pyridine-2-carbonitrile);5-[(4-methoxyphenyl)methyl-[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile;5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole (PubChem CID 172928081) has the molecular formula C91H65BrClF15N30O8 and a molecular weight of 2107.05 g/mol. Its IUPAC name is 5-aminopyridine-2-carbonitrile;2-bromo-5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole;2-chloro-5-(trifluoromethyl)pyrazine;N'-hydroxy-5-[[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide;bis(5-[(4-methoxyphenyl)methylamino]pyridine-2-carbonitrile);5-[(4-methoxyphenyl)methyl-[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile;5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole.

Molecular Properties

• Compound Name: 5-aminopyridine-2-carbonitrile;2-bromo-5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole;2-chloro-5-(trifluoromethyl)pyrazine;N'-hydroxy-5-[[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide;bis(5-[(4-methoxyphenyl)methylamino]pyridine-2-carbonitrile);5-[(4-methoxyphenyl)methyl-[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile;5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole
• PubChem CID: 172928081
• Molecular Formula: C91H65BrClF15N30O8
• Molecular Weight: 2107.05 g/mol
• Exact Mass: 2104.42
• IUPAC Name: 5-aminopyridine-2-carbonitrile;2-bromo-5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole;2-chloro-5-(trifluoromethyl)pyrazine;N'-hydroxy-5-[[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide;bis(5-[(4-methoxyphenyl)methylamino]pyridine-2-carbonitrile);5-[(4-methoxyphenyl)methyl-[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile;5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole
• SMILES: COc1ccc(CN(c2ccc(C#N)nc2)c2ncc(-c3cnc(C(F)(F)F)cn3)o2)cc1.COc1ccc(CNc2ccc(C#N)nc2)cc1.COc1ccc(CNc2ccc(C#N)nc2)cc1.FC(F)(F)c1cnc(-c2cnc(Br)o2)cn1.FC(F)(F)c1cnc(-c2cnco2)cn1.FC(F)(F)c1cnc(Cl)cn1.N#Cc1ccc(N)cn1.N/C(=N/O)c1ccc(Nc2ncc(-c3cnc(C(F)(F)F)cn3)o2)cn1
• InChI: InChI=1S/C22H15F3N6O2.C14H10F3N7O2.2C14H13N3O.C8H3BrF3N3O.C8H4F3N3O.C6H5N3.C5H2ClF3N2/c1-32-17-6-2-14(3-7-17)13-31(16-5-4-15(8-26)27-9-16)21-30-11-19(33-21)18-10-29-20(12-28-18)22(23,24)25;15-14(16,17)11-6-20-9(4-21-11)10-5-22-13(26-10)23-7-1-2-8(19-3-7)12(18)24-25;2*1-18-14-6-2-11(3-7-14)9-16-13-5-4-12(8-15)17-10-13;9-7-15-2-5(16-7)4-1-14-6(3-13-4)8(10,11)12;9-8(10,11)7-3-13-5(1-14-7)6-2-12-4-15-6;7-3-6-2-1-5(8)4-9-6;6-4-2-10-3(1-11-4)5(7,8)9/h2-7,9-12H,13H2,1H3;1-6,25H,(H2,18,24)(H,22,23);2*2-7,10,16H,9H2,1H3;1-3H;1-4H;1-2,4H,8H2;1-2H
• InChIKey: NIUOAZSYAKCFJP-UHFFFAOYSA-N
• XLogP: 20.04
• TPSA: 544.28 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 37
• Rotatable Bonds: 20
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2107.05
LogP ≤ 5	20.04
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-aminopyridine-2-carbonitrile;2-bromo-5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole;2-chloro-5-(trifluoromethyl)pyrazine;N'-hydroxy-5-[[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide;bis(5-[(4-methoxyphenyl)methylamino]pyridine-2-carbonitrile);5-[(4-methoxyphenyl)methyl-[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile;5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole?

The IUPAC name of 5-aminopyridine-2-carbonitrile;2-bromo-5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole;2-chloro-5-(trifluoromethyl)pyrazine;N'-hydroxy-5-[[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide;bis(5-[(4-methoxyphenyl)methylamino]pyridine-2-carbonitrile);5-[(4-methoxyphenyl)methyl-[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile;5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole (CID 172928081) is 5-aminopyridine-2-carbonitrile;2-bromo-5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole;2-chloro-5-(trifluoromethyl)pyrazine;N'-hydroxy-5-[[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide;bis(5-[(4-methoxyphenyl)methylamino]pyridine-2-carbonitrile);5-[(4-methoxyphenyl)methyl-[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile;5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole.

What is the SMILES notation for 5-aminopyridine-2-carbonitrile;2-bromo-5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole;2-chloro-5-(trifluoromethyl)pyrazine;N'-hydroxy-5-[[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide;bis(5-[(4-methoxyphenyl)methylamino]pyridine-2-carbonitrile);5-[(4-methoxyphenyl)methyl-[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile;5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole?

The canonical SMILES for 5-aminopyridine-2-carbonitrile;2-bromo-5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole;2-chloro-5-(trifluoromethyl)pyrazine;N'-hydroxy-5-[[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide;bis(5-[(4-methoxyphenyl)methylamino]pyridine-2-carbonitrile);5-[(4-methoxyphenyl)methyl-[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile;5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole is COc1ccc(CN(c2ccc(C#N)nc2)c2ncc(-c3cnc(C(F)(F)F)cn3)o2)cc1.COc1ccc(CNc2ccc(C#N)nc2)cc1.COc1ccc(CNc2ccc(C#N)nc2)cc1.FC(F)(F)c1cnc(-c2cnc(Br)o2)cn1.FC(F)(F)c1cnc(-c2cnco2)cn1.FC(F)(F)c1cnc(Cl)cn1.N#Cc1ccc(N)cn1.N/C(=N/O)c1ccc(Nc2ncc(-c3cnc(C(F)(F)F)cn3)o2)cn1.

What is the InChIKey of 5-aminopyridine-2-carbonitrile;2-bromo-5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole;2-chloro-5-(trifluoromethyl)pyrazine;N'-hydroxy-5-[[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide;bis(5-[(4-methoxyphenyl)methylamino]pyridine-2-carbonitrile);5-[(4-methoxyphenyl)methyl-[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile;5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole?

The InChIKey is NIUOAZSYAKCFJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15F3N6O2.C14H10F3N7O2.2C14H13N3O.C8H3BrF3N3O.C8H4F3N3O.C6H5N3.C5H2ClF3N2/c1-32-17-6-2-14(3-7-17)13-31(16-5-4-15(8-26)27-9-16)21-30-11-19(33-21)18-10-29-20(12-28-18)22(23,24)25;15-14(16,17)11-6-20-9(4-21-11)10-5-22-13(26-10)23-7-1-2-8(19-3-7)12(18)24-25;2*1-18-14-6-2-11(3-7-14)9-16-13-5-4-12(8-15)17-10-13;9-7-15-2-5(16-7)4-1-14-6(3-13-4)8(10,11)12;9-8(10,11)7-3-13-5(1-14-7)6-2-12-4-15-6;7-3-6-2-1-5(8)4-9-6;6-4-2-10-3(1-11-4)5(7,8)9/h2-7,9-12H,13H2,1H3;1-6,25H,(H2,18,24)(H,22,23);2*2-7,10,16H,9H2,1H3;1-3H;1-4H;1-2,4H,8H2;1-2H.

What are the key properties of 5-aminopyridine-2-carbonitrile;2-bromo-5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole;2-chloro-5-(trifluoromethyl)pyrazine;N'-hydroxy-5-[[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide;bis(5-[(4-methoxyphenyl)methylamino]pyridine-2-carbonitrile);5-[(4-methoxyphenyl)methyl-[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile;5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole?

5-aminopyridine-2-carbonitrile;2-bromo-5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole;2-chloro-5-(trifluoromethyl)pyrazine;N'-hydroxy-5-[[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide;bis(5-[(4-methoxyphenyl)methylamino]pyridine-2-carbonitrile);5-[(4-methoxyphenyl)methyl-[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile;5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole has a molecular weight of 2107.05 g/mol, XLogP of 20.04, 20 rotatable bonds, 6 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for 5-aminopyridine-2-carbonitrile;2-bromo-5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole;2-chloro-5-(trifluoromethyl)pyrazine;N'-hydroxy-5-[[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide;bis(5-[(4-methoxyphenyl)methylamino]pyridine-2-carbonitrile);5-[(4-methoxyphenyl)methyl-[5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazol-2-yl]amino]pyridine-2-carbonitrile;5-[5-(trifluoromethyl)pyrazin-2-yl]-1,3-oxazole is sourced from PubChem (CID 172928081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).