N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-ethynylphenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-ethynyl-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide

C129H92F23N25O16 — CID 159583852

About N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-ethynylphenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-ethynyl-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide

N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-ethynylphenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-ethynyl-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide (PubChem CID 159583852) has the molecular formula C129H92F23N25O16 and a molecular weight of 2685.27 g/mol. Its IUPAC name is N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-ethynylphenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-ethynyl-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

• Compound Name: N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-ethynylphenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-ethynyl-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
• PubChem CID: 159583852
• Molecular Formula: C129H92F23N25O16
• Molecular Weight: 2685.27 g/mol
• Exact Mass: 2683.68
• IUPAC Name: N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-ethynylphenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-ethynyl-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
• SMILES: C#Cc1ccc(Cn2cc(NC(=O)c3cc(-c4ccco4)on3)cn2)cc1.C#Cc1ccc(Cn2cc(NC(=O)c3cc(-c4ccco4)on3)cn2)cc1C(F)(F)F.CC(F)(F)c1cc(Cn2cc(NC(=O)c3cc(-c4ccco4)on3)cn2)cc(C(F)(F)F)c1.CC(F)(F)c1ccc(-n2cc(CC(=O)c3cc(-c4ccco4)on3)cn2)c(C(F)(F)F)c1.Cc1c(NC(=O)c2cc(-c3ccccn3)on2)cnn1Cc1ccc(C(C)(F)F)cc1C(F)(F)F.Cc1nn(Cc2ccc(C(C)(F)F)cc2C(F)(F)F)cc1NC(=O)c1cc(-c2ccccn2)on1
• InChI: InChI=1S/2C23H18F5N5O2.C21H15F5N4O3.C21H14F5N3O3.C21H13F3N4O3.C20H14N4O3/c1-13-19(31-21(34)18-10-20(35-32-18)17-5-3-4-8-29-17)11-30-33(13)12-14-6-7-15(22(2,24)25)9-16(14)23(26,27)28;1-13-19(30-21(34)18-10-20(35-32-18)17-5-3-4-8-29-17)12-33(31-13)11-14-6-7-15(22(2,24)25)9-16(14)23(26,27)28;1-20(22,23)13-5-12(6-14(7-13)21(24,25)26)10-30-11-15(9-27-30)28-19(31)16-8-18(33-29-16)17-3-2-4-32-17;1-20(22,23)13-4-5-16(14(8-13)21(24,25)26)29-11-12(10-27-29)7-17(30)15-9-19(32-28-15)18-3-2-6-31-18;1-2-14-6-5-13(8-16(14)21(22,23)24)11-28-12-15(10-25-28)26-20(29)17-9-19(31-27-17)18-4-3-7-30-18;1-2-14-5-7-15(8-6-14)12-24-13-16(11-21-24)22-20(25)17-10-19(27-23-17)18-4-3-9-26-18/h3-11H,12H2,1-2H3,(H,31,34);3-10,12H,11H2,1-2H3,(H,30,34);2-9,11H,10H2,1H3,(H,28,31);2-6,8-11H,7H2,1H3;1,3-10,12H,11H2,(H,26,29);1,3-11,13H,12H2,(H,22,25)
• InChIKey: MJJBGZKANZHCPF-UHFFFAOYSA-N
• XLogP: 30.43
• TPSA: 504.01 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 36
• Rotatable Bonds: 34
• Heavy Atoms: 193
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2685.27
LogP ≤ 5	30.43
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-ethynylphenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-ethynyl-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?

The IUPAC name of N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-ethynylphenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-ethynyl-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide (CID 159583852) is N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-ethynylphenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-ethynyl-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide.

What is the SMILES notation for N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-ethynylphenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-ethynyl-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?

The canonical SMILES for N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-ethynylphenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-ethynyl-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide is C#Cc1ccc(Cn2cc(NC(=O)c3cc(-c4ccco4)on3)cn2)cc1.C#Cc1ccc(Cn2cc(NC(=O)c3cc(-c4ccco4)on3)cn2)cc1C(F)(F)F.CC(F)(F)c1cc(Cn2cc(NC(=O)c3cc(-c4ccco4)on3)cn2)cc(C(F)(F)F)c1.CC(F)(F)c1ccc(-n2cc(CC(=O)c3cc(-c4ccco4)on3)cn2)c(C(F)(F)F)c1.Cc1c(NC(=O)c2cc(-c3ccccn3)on2)cnn1Cc1ccc(C(C)(F)F)cc1C(F)(F)F.Cc1nn(Cc2ccc(C(C)(F)F)cc2C(F)(F)F)cc1NC(=O)c1cc(-c2ccccn2)on1.

What is the InChIKey of N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-ethynylphenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-ethynyl-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?

The InChIKey is MJJBGZKANZHCPF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C23H18F5N5O2.C21H15F5N4O3.C21H14F5N3O3.C21H13F3N4O3.C20H14N4O3/c1-13-19(31-21(34)18-10-20(35-32-18)17-5-3-4-8-29-17)11-30-33(13)12-14-6-7-15(22(2,24)25)9-16(14)23(26,27)28;1-13-19(30-21(34)18-10-20(35-32-18)17-5-3-4-8-29-17)12-33(31-13)11-14-6-7-15(22(2,24)25)9-16(14)23(26,27)28;1-20(22,23)13-5-12(6-14(7-13)21(24,25)26)10-30-11-15(9-27-30)28-19(31)16-8-18(33-29-16)17-3-2-4-32-17;1-20(22,23)13-4-5-16(14(8-13)21(24,25)26)29-11-12(10-27-29)7-17(30)15-9-19(32-28-15)18-3-2-6-31-18;1-2-14-6-5-13(8-16(14)21(22,23)24)11-28-12-15(10-25-28)26-20(29)17-9-19(31-27-17)18-4-3-7-30-18;1-2-14-5-7-15(8-6-14)12-24-13-16(11-21-24)22-20(25)17-10-19(27-23-17)18-4-3-9-26-18/h3-11H,12H2,1-2H3,(H,31,34);3-10,12H,11H2,1-2H3,(H,30,34);2-9,11H,10H2,1H3,(H,28,31);2-6,8-11H,7H2,1H3;1,3-10,12H,11H2,(H,26,29);1,3-11,13H,12H2,(H,22,25).

What are the key properties of N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-ethynylphenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-ethynyl-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?

N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-ethynylphenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-ethynyl-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 2685.27 g/mol, XLogP of 30.43, 34 rotatable bonds, 5 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[4-(1,1-difluoroethyl)-2-(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-ethynylphenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-ethynyl-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 159583852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).