N-[(5-fluoro-2-methylphenyl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-[(5-methylfuran-2-yl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-methyl-N-(2-methylpropyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2-morpholin-4-ylethyl)thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide

C77H75F19N16O7S5 — CID 159534977

About N-[(5-fluoro-2-methylphenyl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-[(5-methylfuran-2-yl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-methyl-N-(2-methylpropyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2-morpholin-4-ylethyl)thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide

N-[(5-fluoro-2-methylphenyl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-[(5-methylfuran-2-yl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-methyl-N-(2-methylpropyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2-morpholin-4-ylethyl)thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide (PubChem CID 159534977) has the molecular formula C77H75F19N16O7S5 and a molecular weight of 1857.85 g/mol. Its IUPAC name is N-[(5-fluoro-2-methylphenyl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-[(5-methylfuran-2-yl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-methyl-N-(2-methylpropyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2-morpholin-4-ylethyl)thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide.

Molecular Properties

• Compound Name: N-[(5-fluoro-2-methylphenyl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-[(5-methylfuran-2-yl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-methyl-N-(2-methylpropyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2-morpholin-4-ylethyl)thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide
• PubChem CID: 159534977
• Molecular Formula: C77H75F19N16O7S5
• Molecular Weight: 1857.85 g/mol
• Exact Mass: 1856.43
• IUPAC Name: N-[(5-fluoro-2-methylphenyl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-[(5-methylfuran-2-yl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-methyl-N-(2-methylpropyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2-morpholin-4-ylethyl)thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide
• SMILES: CC(C)CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)n(C)n2)s1.Cc1ccc(CNC(=O)c2ccc(-c3cc(C(F)(F)F)n(C)n3)s2)o1.Cc1ccc(F)cc1CNC(=O)c1ccc(-c2cc(C(F)(F)F)n(C)n2)s1.Cn1nc(-c2ccc(C(=O)NCC(F)(F)F)s2)cc1C(F)(F)F.Cn1nc(-c2ccc(C(=O)NCCN3CCOCC3)s2)cc1C(F)(F)F
• InChI: InChI=1S/C18H15F4N3OS.C16H19F3N4O2S.C16H14F3N3O2S.C15H18F3N3OS.C12H9F6N3OS/c1-10-3-4-12(19)7-11(10)9-23-17(26)15-6-5-14(27-15)13-8-16(18(20,21)22)25(2)24-13;1-22-14(16(17,18)19)10-11(21-22)12-2-3-13(26-12)15(24)20-4-5-23-6-8-25-9-7-23;1-9-3-4-10(24-9)8-20-15(23)13-6-5-12(25-13)11-7-14(16(17,18)19)22(2)21-11;1-9(2)8-20(3)14(22)12-6-5-11(23-12)10-7-13(15(16,17)18)21(4)19-10;1-21-9(12(16,17)18)4-6(20-21)7-2-3-8(23-7)10(22)19-5-11(13,14)15/h3-8H,9H2,1-2H3,(H,23,26);2-3,10H,4-9H2,1H3,(H,20,24);3-7H,8H2,1-2H3,(H,20,23);5-7,9H,8H2,1-4H3;2-4H,5H2,1H3,(H,19,22)
• InChIKey: MDMABLQQPHUBMA-UHFFFAOYSA-N
• XLogP: 18.13
• TPSA: 251.42 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 23
• Rotatable Bonds: 20
• Heavy Atoms: 124
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1857.85
LogP ≤ 5	18.13
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of N-[(5-fluoro-2-methylphenyl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-[(5-methylfuran-2-yl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-methyl-N-(2-methylpropyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2-morpholin-4-ylethyl)thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide?

The IUPAC name of N-[(5-fluoro-2-methylphenyl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-[(5-methylfuran-2-yl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-methyl-N-(2-methylpropyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2-morpholin-4-ylethyl)thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide (CID 159534977) is N-[(5-fluoro-2-methylphenyl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-[(5-methylfuran-2-yl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-methyl-N-(2-methylpropyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2-morpholin-4-ylethyl)thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide.

What is the SMILES notation for N-[(5-fluoro-2-methylphenyl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-[(5-methylfuran-2-yl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-methyl-N-(2-methylpropyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2-morpholin-4-ylethyl)thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide?

The canonical SMILES for N-[(5-fluoro-2-methylphenyl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-[(5-methylfuran-2-yl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-methyl-N-(2-methylpropyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2-morpholin-4-ylethyl)thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide is CC(C)CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)n(C)n2)s1.Cc1ccc(CNC(=O)c2ccc(-c3cc(C(F)(F)F)n(C)n3)s2)o1.Cc1ccc(F)cc1CNC(=O)c1ccc(-c2cc(C(F)(F)F)n(C)n2)s1.Cn1nc(-c2ccc(C(=O)NCC(F)(F)F)s2)cc1C(F)(F)F.Cn1nc(-c2ccc(C(=O)NCCN3CCOCC3)s2)cc1C(F)(F)F.

What is the InChIKey of N-[(5-fluoro-2-methylphenyl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-[(5-methylfuran-2-yl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-methyl-N-(2-methylpropyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2-morpholin-4-ylethyl)thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide?

The InChIKey is MDMABLQQPHUBMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15F4N3OS.C16H19F3N4O2S.C16H14F3N3O2S.C15H18F3N3OS.C12H9F6N3OS/c1-10-3-4-12(19)7-11(10)9-23-17(26)15-6-5-14(27-15)13-8-16(18(20,21)22)25(2)24-13;1-22-14(16(17,18)19)10-11(21-22)12-2-3-13(26-12)15(24)20-4-5-23-6-8-25-9-7-23;1-9-3-4-10(24-9)8-20-15(23)13-6-5-12(25-13)11-7-14(16(17,18)19)22(2)21-11;1-9(2)8-20(3)14(22)12-6-5-11(23-12)10-7-13(15(16,17)18)21(4)19-10;1-21-9(12(16,17)18)4-6(20-21)7-2-3-8(23-7)10(22)19-5-11(13,14)15/h3-8H,9H2,1-2H3,(H,23,26);2-3,10H,4-9H2,1H3,(H,20,24);3-7H,8H2,1-2H3,(H,20,23);5-7,9H,8H2,1-4H3;2-4H,5H2,1H3,(H,19,22).

What are the key properties of N-[(5-fluoro-2-methylphenyl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-[(5-methylfuran-2-yl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-methyl-N-(2-methylpropyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2-morpholin-4-ylethyl)thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide?

N-[(5-fluoro-2-methylphenyl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-[(5-methylfuran-2-yl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-methyl-N-(2-methylpropyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2-morpholin-4-ylethyl)thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide has a molecular weight of 1857.85 g/mol, XLogP of 18.13, 20 rotatable bonds, 4 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(5-fluoro-2-methylphenyl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-[(5-methylfuran-2-yl)methyl]-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;N-methyl-N-(2-methylpropyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2-morpholin-4-ylethyl)thiophene-2-carboxamide;5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-N-(2,2,2-trifluoroethyl)thiophene-2-carboxamide is sourced from PubChem (CID 159534977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).