N-[1-[1-[2,4-bis(trifluoromethyl)phenyl]ethyl]pyrazol-4-yl]-3-pyrazin-2-yl-1,2-oxazole-5-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]-3-methylpyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,3,4-thiadiazole-2-carboxamide;N-[1-[1-(2,6-difluorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;5-(furan-2-yl)-N-[1-[1-(2,4,6-trifluorophenyl)ethyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide

C97H70Cl4F11N23O13S — CID 167644034

About N-[1-[1-[2,4-bis(trifluoromethyl)phenyl]ethyl]pyrazol-4-yl]-3-pyrazin-2-yl-1,2-oxazole-5-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]-3-methylpyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,3,4-thiadiazole-2-carboxamide;N-[1-[1-(2,6-difluorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;5-(furan-2-yl)-N-[1-[1-(2,4,6-trifluorophenyl)ethyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide

N-[1-[1-[2,4-bis(trifluoromethyl)phenyl]ethyl]pyrazol-4-yl]-3-pyrazin-2-yl-1,2-oxazole-5-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]-3-methylpyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,3,4-thiadiazole-2-carboxamide;N-[1-[1-(2,6-difluorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;5-(furan-2-yl)-N-[1-[1-(2,4,6-trifluorophenyl)ethyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide (PubChem CID 167644034) has the molecular formula C97H70Cl4F11N23O13S and a molecular weight of 2148.63 g/mol. Its IUPAC name is N-[1-[1-[2,4-bis(trifluoromethyl)phenyl]ethyl]pyrazol-4-yl]-3-pyrazin-2-yl-1,2-oxazole-5-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]-3-methylpyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,3,4-thiadiazole-2-carboxamide;N-[1-[1-(2,6-difluorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;5-(furan-2-yl)-N-[1-[1-(2,4,6-trifluorophenyl)ethyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide.

Molecular Properties

• Compound Name: N-[1-[1-[2,4-bis(trifluoromethyl)phenyl]ethyl]pyrazol-4-yl]-3-pyrazin-2-yl-1,2-oxazole-5-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]-3-methylpyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,3,4-thiadiazole-2-carboxamide;N-[1-[1-(2,6-difluorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;5-(furan-2-yl)-N-[1-[1-(2,4,6-trifluorophenyl)ethyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide
• PubChem CID: 167644034
• Molecular Formula: C97H70Cl4F11N23O13S
• Molecular Weight: 2148.63 g/mol
• Exact Mass: 2145.38
• IUPAC Name: N-[1-[1-[2,4-bis(trifluoromethyl)phenyl]ethyl]pyrazol-4-yl]-3-pyrazin-2-yl-1,2-oxazole-5-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]-3-methylpyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,3,4-thiadiazole-2-carboxamide;N-[1-[1-(2,6-difluorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;5-(furan-2-yl)-N-[1-[1-(2,4,6-trifluorophenyl)ethyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide
• SMILES: CC(c1c(Cl)cccc1Cl)n1cc(NC(=O)c2nnc(-c3ccco3)s2)cn1.CC(c1c(F)cc(F)cc1F)n1cc(NC(=O)c2cc(-c3ccco3)on2)cn1.CC(c1c(F)cccc1F)n1cc(NC(=O)c2cc(-c3ccco3)on2)cn1.CC(c1ccc(C(F)(F)F)cc1C(F)(F)F)n1cc(NC(=O)c2cc(-c3cnccn3)no2)cn1.Cc1nn(C(C)c2c(Cl)cccc2Cl)cc1NC(=O)c1cc(-c2ccco2)on1
• InChI: InChI=1S/C21H14F6N6O2.C20H16Cl2N4O3.C19H13F3N4O3.C19H14F2N4O3.C18H13Cl2N5O2S/c1-11(14-3-2-12(20(22,23)24)6-15(14)21(25,26)27)33-10-13(8-30-33)31-19(34)18-7-16(32-35-18)17-9-28-4-5-29-17;1-11-16(10-26(24-11)12(2)19-13(21)5-3-6-14(19)22)23-20(27)15-9-18(29-25-15)17-7-4-8-28-17;1-10(18-13(21)5-11(20)6-14(18)22)26-9-12(8-23-26)24-19(27)15-7-17(29-25-15)16-3-2-4-28-16;1-11(18-13(20)4-2-5-14(18)21)25-10-12(9-22-25)23-19(26)15-8-17(28-24-15)16-6-3-7-27-16;1-10(15-12(19)4-2-5-13(15)20)25-9-11(8-21-25)22-16(26)18-24-23-17(28-18)14-6-3-7-27-14/h2-11H,1H3,(H,31,34);3-10,12H,1-2H3,(H,23,27);2-10H,1H3,(H,24,27);2-11H,1H3,(H,23,26);2-10H,1H3,(H,22,26)
• InChIKey: POTRNIMVKFVKOR-UHFFFAOYSA-N
• XLogP: 24.68
• TPSA: 442.84 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 32
• Rotatable Bonds: 25
• Heavy Atoms: 149
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2148.63
LogP ≤ 5	24.68
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of N-[1-[1-[2,4-bis(trifluoromethyl)phenyl]ethyl]pyrazol-4-yl]-3-pyrazin-2-yl-1,2-oxazole-5-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]-3-methylpyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,3,4-thiadiazole-2-carboxamide;N-[1-[1-(2,6-difluorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;5-(furan-2-yl)-N-[1-[1-(2,4,6-trifluorophenyl)ethyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide?

The IUPAC name of N-[1-[1-[2,4-bis(trifluoromethyl)phenyl]ethyl]pyrazol-4-yl]-3-pyrazin-2-yl-1,2-oxazole-5-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]-3-methylpyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,3,4-thiadiazole-2-carboxamide;N-[1-[1-(2,6-difluorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;5-(furan-2-yl)-N-[1-[1-(2,4,6-trifluorophenyl)ethyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide (CID 167644034) is N-[1-[1-[2,4-bis(trifluoromethyl)phenyl]ethyl]pyrazol-4-yl]-3-pyrazin-2-yl-1,2-oxazole-5-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]-3-methylpyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,3,4-thiadiazole-2-carboxamide;N-[1-[1-(2,6-difluorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;5-(furan-2-yl)-N-[1-[1-(2,4,6-trifluorophenyl)ethyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide.

What is the SMILES notation for N-[1-[1-[2,4-bis(trifluoromethyl)phenyl]ethyl]pyrazol-4-yl]-3-pyrazin-2-yl-1,2-oxazole-5-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]-3-methylpyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,3,4-thiadiazole-2-carboxamide;N-[1-[1-(2,6-difluorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;5-(furan-2-yl)-N-[1-[1-(2,4,6-trifluorophenyl)ethyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide?

The canonical SMILES for N-[1-[1-[2,4-bis(trifluoromethyl)phenyl]ethyl]pyrazol-4-yl]-3-pyrazin-2-yl-1,2-oxazole-5-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]-3-methylpyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,3,4-thiadiazole-2-carboxamide;N-[1-[1-(2,6-difluorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;5-(furan-2-yl)-N-[1-[1-(2,4,6-trifluorophenyl)ethyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide is CC(c1c(Cl)cccc1Cl)n1cc(NC(=O)c2nnc(-c3ccco3)s2)cn1.CC(c1c(F)cc(F)cc1F)n1cc(NC(=O)c2cc(-c3ccco3)on2)cn1.CC(c1c(F)cccc1F)n1cc(NC(=O)c2cc(-c3ccco3)on2)cn1.CC(c1ccc(C(F)(F)F)cc1C(F)(F)F)n1cc(NC(=O)c2cc(-c3cnccn3)no2)cn1.Cc1nn(C(C)c2c(Cl)cccc2Cl)cc1NC(=O)c1cc(-c2ccco2)on1.

What is the InChIKey of N-[1-[1-[2,4-bis(trifluoromethyl)phenyl]ethyl]pyrazol-4-yl]-3-pyrazin-2-yl-1,2-oxazole-5-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]-3-methylpyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,3,4-thiadiazole-2-carboxamide;N-[1-[1-(2,6-difluorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;5-(furan-2-yl)-N-[1-[1-(2,4,6-trifluorophenyl)ethyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide?

The InChIKey is POTRNIMVKFVKOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14F6N6O2.C20H16Cl2N4O3.C19H13F3N4O3.C19H14F2N4O3.C18H13Cl2N5O2S/c1-11(14-3-2-12(20(22,23)24)6-15(14)21(25,26)27)33-10-13(8-30-33)31-19(34)18-7-16(32-35-18)17-9-28-4-5-29-17;1-11-16(10-26(24-11)12(2)19-13(21)5-3-6-14(19)22)23-20(27)15-9-18(29-25-15)17-7-4-8-28-17;1-10(18-13(21)5-11(20)6-14(18)22)26-9-12(8-23-26)24-19(27)15-7-17(29-25-15)16-3-2-4-28-16;1-11(18-13(20)4-2-5-14(18)21)25-10-12(9-22-25)23-19(26)15-8-17(28-24-15)16-6-3-7-27-16;1-10(15-12(19)4-2-5-13(15)20)25-9-11(8-21-25)22-16(26)18-24-23-17(28-18)14-6-3-7-27-14/h2-11H,1H3,(H,31,34);3-10,12H,1-2H3,(H,23,27);2-10H,1H3,(H,24,27);2-11H,1H3,(H,23,26);2-10H,1H3,(H,22,26).

What are the key properties of N-[1-[1-[2,4-bis(trifluoromethyl)phenyl]ethyl]pyrazol-4-yl]-3-pyrazin-2-yl-1,2-oxazole-5-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]-3-methylpyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,3,4-thiadiazole-2-carboxamide;N-[1-[1-(2,6-difluorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;5-(furan-2-yl)-N-[1-[1-(2,4,6-trifluorophenyl)ethyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide?

N-[1-[1-[2,4-bis(trifluoromethyl)phenyl]ethyl]pyrazol-4-yl]-3-pyrazin-2-yl-1,2-oxazole-5-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]-3-methylpyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,3,4-thiadiazole-2-carboxamide;N-[1-[1-(2,6-difluorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;5-(furan-2-yl)-N-[1-[1-(2,4,6-trifluorophenyl)ethyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide has a molecular weight of 2148.63 g/mol, XLogP of 24.68, 25 rotatable bonds, 5 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-[1-[2,4-bis(trifluoromethyl)phenyl]ethyl]pyrazol-4-yl]-3-pyrazin-2-yl-1,2-oxazole-5-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]-3-methylpyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;N-[1-[1-(2,6-dichlorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,3,4-thiadiazole-2-carboxamide;N-[1-[1-(2,6-difluorophenyl)ethyl]pyrazol-4-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;5-(furan-2-yl)-N-[1-[1-(2,4,6-trifluorophenyl)ethyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 167644034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).