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

C123H78F27N27O16 — CID 158100515

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

N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3,5-bis(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[2,4-bis(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-cyanophenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-cyano-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide (PubChem CID 158100515) has the molecular formula C123H78F27N27O16 and a molecular weight of 2703.10 g/mol. Its IUPAC name is N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3,5-bis(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[2,4-bis(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-cyanophenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-cyano-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

• Compound Name: N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3,5-bis(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[2,4-bis(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-cyanophenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-cyano-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
• PubChem CID: 158100515
• Molecular Formula: C123H78F27N27O16
• Molecular Weight: 2703.10 g/mol
• Exact Mass: 2701.57
• IUPAC Name: N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3,5-bis(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[2,4-bis(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-cyanophenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-cyano-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
• SMILES: Cc1c(NC(=O)c2cc(-c3ccccn3)on2)cnn1Cc1ccc(C(F)(F)F)cc1C(F)(F)F.Cc1nn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)cc1NC(=O)c1cc(-c2ccccn2)on1.N#Cc1ccc(Cn2cc(NC(=O)c3cc(-c4ccco4)on3)cn2)cc1.N#Cc1ccc(Cn2cc(NC(=O)c3cc(-c4ccco4)on3)cn2)cc1C(F)(F)F.O=C(Cc1cnn(-c2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1.O=C(Nc1cnn(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1)c1cc(-c2ccco2)on1
• InChI: InChI=1S/2C22H15F6N5O2.C20H12F6N4O3.C20H11F6N3O3.C20H12F3N5O3.C19H13N5O3/c1-12-18(31-20(34)17-9-19(35-32-17)16-4-2-3-7-29-16)10-30-33(12)11-13-5-6-14(21(23,24)25)8-15(13)22(26,27)28;1-12-18(30-20(34)17-9-19(35-32-17)16-4-2-3-7-29-16)11-33(31-12)10-13-5-6-14(21(23,24)25)8-15(13)22(26,27)28;21-19(22,23)12-4-11(5-13(6-12)20(24,25)26)9-30-10-14(8-27-30)28-18(31)15-7-17(33-29-15)16-2-1-3-32-16;21-19(22,23)12-3-4-15(13(7-12)20(24,25)26)29-10-11(9-27-29)6-16(30)14-8-18(32-28-14)17-2-1-5-31-17;21-20(22,23)15-6-12(3-4-13(15)8-24)10-28-11-14(9-25-28)26-19(29)16-7-18(31-27-16)17-2-1-5-30-17;20-9-13-3-5-14(6-4-13)11-24-12-15(10-21-24)22-19(25)16-8-18(27-23-16)17-2-1-7-26-17/h2-10H,11H2,1H3,(H,31,34);2-9,11H,10H2,1H3,(H,30,34);1-8,10H,9H2,(H,28,31);1-5,7-10H,6H2;1-7,9,11H,10H2,(H,26,29);1-8,10,12H,11H2,(H,22,25)
• InChIKey: FPEWPPZBXTZLMD-UHFFFAOYSA-N
• XLogP: 29.84
• TPSA: 551.59 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 38
• Rotatable Bonds: 30
• Heavy Atoms: 193
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2703.10
LogP ≤ 5	29.84
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	38

Frequently Asked Questions

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

The IUPAC name of N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3,5-bis(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[2,4-bis(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-cyanophenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-cyano-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide (CID 158100515) is N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3,5-bis(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[2,4-bis(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-cyanophenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-cyano-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide.

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

The canonical SMILES for N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3,5-bis(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[2,4-bis(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-cyanophenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-cyano-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide is Cc1c(NC(=O)c2cc(-c3ccccn3)on2)cnn1Cc1ccc(C(F)(F)F)cc1C(F)(F)F.Cc1nn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)cc1NC(=O)c1cc(-c2ccccn2)on1.N#Cc1ccc(Cn2cc(NC(=O)c3cc(-c4ccco4)on3)cn2)cc1.N#Cc1ccc(Cn2cc(NC(=O)c3cc(-c4ccco4)on3)cn2)cc1C(F)(F)F.O=C(Cc1cnn(-c2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccco2)on1.O=C(Nc1cnn(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1)c1cc(-c2ccco2)on1.

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

The InChIKey is FPEWPPZBXTZLMD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C22H15F6N5O2.C20H12F6N4O3.C20H11F6N3O3.C20H12F3N5O3.C19H13N5O3/c1-12-18(31-20(34)17-9-19(35-32-17)16-4-2-3-7-29-16)10-30-33(12)11-13-5-6-14(21(23,24)25)8-15(13)22(26,27)28;1-12-18(30-20(34)17-9-19(35-32-17)16-4-2-3-7-29-16)11-33(31-12)10-13-5-6-14(21(23,24)25)8-15(13)22(26,27)28;21-19(22,23)12-4-11(5-13(6-12)20(24,25)26)9-30-10-14(8-27-30)28-18(31)15-7-17(33-29-15)16-2-1-3-32-16;21-19(22,23)12-3-4-15(13(7-12)20(24,25)26)29-10-11(9-27-29)6-16(30)14-8-18(32-28-14)17-2-1-5-31-17;21-20(22,23)15-6-12(3-4-13(15)8-24)10-28-11-14(9-25-28)26-19(29)16-7-18(31-27-16)17-2-1-5-30-17;20-9-13-3-5-14(6-4-13)11-24-12-15(10-21-24)22-19(25)16-8-18(27-23-16)17-2-1-7-26-17/h2-10H,11H2,1H3,(H,31,34);2-9,11H,10H2,1H3,(H,30,34);1-8,10H,9H2,(H,28,31);1-5,7-10H,6H2;1-7,9,11H,10H2,(H,26,29);1-8,10,12H,11H2,(H,22,25).

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

N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3,5-bis(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[2,4-bis(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-cyanophenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-cyano-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 2703.10 g/mol, XLogP of 29.84, 30 rotatable bonds, 5 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-3-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]-5-methylpyrazol-4-yl]-5-pyridin-2-yl-1,2-oxazole-3-carboxamide;N-[1-[[3,5-bis(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;2-[1-[2,4-bis(trifluoromethyl)phenyl]pyrazol-4-yl]-1-[5-(furan-2-yl)-1,2-oxazol-3-yl]ethanone;N-[1-[(4-cyanophenyl)methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[[4-cyano-3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 158100515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).