5-[1-cyclopentyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylthiophene-2-carboxamide;N,N-dimethyl-3-[1-propan-2-yl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-5-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carboxamide;N,N-dimethyl-4-[3-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-5-yl]benzamide;2-methyl-1-[5-[1-(4-nitrophenyl)-3-phenylpyrazol-5-yl]thiophen-2-yl]propan-1-one

C105H104F18N18O8S3 — CID 159766411

About 5-[1-cyclopentyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylthiophene-2-carboxamide;N,N-dimethyl-3-[1-propan-2-yl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-5-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carboxamide;N,N-dimethyl-4-[3-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-5-yl]benzamide;2-methyl-1-[5-[1-(4-nitrophenyl)-3-phenylpyrazol-5-yl]thiophen-2-yl]propan-1-one

5-[1-cyclopentyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylthiophene-2-carboxamide;N,N-dimethyl-3-[1-propan-2-yl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-5-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carboxamide;N,N-dimethyl-4-[3-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-5-yl]benzamide;2-methyl-1-[5-[1-(4-nitrophenyl)-3-phenylpyrazol-5-yl]thiophen-2-yl]propan-1-one (PubChem CID 159766411) has the molecular formula C105H104F18N18O8S3 and a molecular weight of 2184.27 g/mol. Its IUPAC name is 5-[1-cyclopentyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylthiophene-2-carboxamide;N,N-dimethyl-3-[1-propan-2-yl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-5-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carboxamide;N,N-dimethyl-4-[3-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-5-yl]benzamide;2-methyl-1-[5-[1-(4-nitrophenyl)-3-phenylpyrazol-5-yl]thiophen-2-yl]propan-1-one.

Molecular Properties

• Compound Name: 5-[1-cyclopentyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylthiophene-2-carboxamide;N,N-dimethyl-3-[1-propan-2-yl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-5-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carboxamide;N,N-dimethyl-4-[3-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-5-yl]benzamide;2-methyl-1-[5-[1-(4-nitrophenyl)-3-phenylpyrazol-5-yl]thiophen-2-yl]propan-1-one
• PubChem CID: 159766411
• Molecular Formula: C105H104F18N18O8S3
• Molecular Weight: 2184.27 g/mol
• Exact Mass: 2182.72
• IUPAC Name: 5-[1-cyclopentyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylthiophene-2-carboxamide;N,N-dimethyl-3-[1-propan-2-yl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-5-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carboxamide;N,N-dimethyl-4-[3-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-5-yl]benzamide;2-methyl-1-[5-[1-(4-nitrophenyl)-3-phenylpyrazol-5-yl]thiophen-2-yl]propan-1-one
• SMILES: CC(C)C(=O)c1ccc(-c2cc(-c3ccccc3)nn2-c2ccc([N+](=O)[O-])cc2)s1.CC(C)n1nc(-c2cccc(C(=O)N(C)C)c2)cc1C(F)(F)F.CCCn1nc(C(F)(F)F)cc1-c1ccc(C(=O)N(C)C)cc1.CCCn1nc(C(F)(F)F)cc1-c1ccc(C(=O)N(C)C)s1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)n(C3CCCC3)n2)s1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(C(F)(F)F)cc2)cc1
• InChI: InChI=1S/C23H19N3O3S.C20H15F6N3O.C16H18F3N3OS.2C16H18F3N3O.C14H16F3N3OS/c1-15(2)23(27)22-13-12-21(30-22)20-14-19(16-6-4-3-5-7-16)24-25(20)17-8-10-18(11-9-17)26(28)29;1-28(2)18(30)13-5-3-12(4-6-13)16-11-17(20(24,25)26)27-29(16)15-9-7-14(8-10-15)19(21,22)23;1-21(2)15(23)13-8-7-12(24-13)11-9-14(16(17,18)19)22(20-11)10-5-3-4-6-10;1-10(2)22-14(16(17,18)19)9-13(20-22)11-6-5-7-12(8-11)15(23)21(3)4;1-4-9-22-13(10-14(20-22)16(17,18)19)11-5-7-12(8-6-11)15(23)21(2)3;1-4-7-20-9(8-12(18-20)14(15,16)17)10-5-6-11(22-10)13(21)19(2)3/h3-15H,1-2H3;3-11H,1-2H3;7-10H,3-6H2,1-2H3;5-10H,1-4H3;5-8,10H,4,9H2,1-3H3;5-6,8H,4,7H2,1-3H3
• InChIKey: NFOCNFQMLLVLDO-UHFFFAOYSA-N
• XLogP: 27.02
• TPSA: 268.68 Ų
• H-Bond Acceptors: 23
• Rotatable Bonds: 23
• Heavy Atoms: 152
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2184.27
LogP ≤ 5	27.02
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-[1-cyclopentyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylthiophene-2-carboxamide;N,N-dimethyl-3-[1-propan-2-yl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-5-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carboxamide;N,N-dimethyl-4-[3-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-5-yl]benzamide;2-methyl-1-[5-[1-(4-nitrophenyl)-3-phenylpyrazol-5-yl]thiophen-2-yl]propan-1-one?

The IUPAC name of 5-[1-cyclopentyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylthiophene-2-carboxamide;N,N-dimethyl-3-[1-propan-2-yl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-5-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carboxamide;N,N-dimethyl-4-[3-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-5-yl]benzamide;2-methyl-1-[5-[1-(4-nitrophenyl)-3-phenylpyrazol-5-yl]thiophen-2-yl]propan-1-one (CID 159766411) is 5-[1-cyclopentyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylthiophene-2-carboxamide;N,N-dimethyl-3-[1-propan-2-yl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-5-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carboxamide;N,N-dimethyl-4-[3-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-5-yl]benzamide;2-methyl-1-[5-[1-(4-nitrophenyl)-3-phenylpyrazol-5-yl]thiophen-2-yl]propan-1-one.

What is the SMILES notation for 5-[1-cyclopentyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylthiophene-2-carboxamide;N,N-dimethyl-3-[1-propan-2-yl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-5-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carboxamide;N,N-dimethyl-4-[3-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-5-yl]benzamide;2-methyl-1-[5-[1-(4-nitrophenyl)-3-phenylpyrazol-5-yl]thiophen-2-yl]propan-1-one?

The canonical SMILES for 5-[1-cyclopentyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylthiophene-2-carboxamide;N,N-dimethyl-3-[1-propan-2-yl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-5-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carboxamide;N,N-dimethyl-4-[3-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-5-yl]benzamide;2-methyl-1-[5-[1-(4-nitrophenyl)-3-phenylpyrazol-5-yl]thiophen-2-yl]propan-1-one is CC(C)C(=O)c1ccc(-c2cc(-c3ccccc3)nn2-c2ccc([N+](=O)[O-])cc2)s1.CC(C)n1nc(-c2cccc(C(=O)N(C)C)c2)cc1C(F)(F)F.CCCn1nc(C(F)(F)F)cc1-c1ccc(C(=O)N(C)C)cc1.CCCn1nc(C(F)(F)F)cc1-c1ccc(C(=O)N(C)C)s1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)n(C3CCCC3)n2)s1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(C(F)(F)F)cc2)cc1.

What is the InChIKey of 5-[1-cyclopentyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylthiophene-2-carboxamide;N,N-dimethyl-3-[1-propan-2-yl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-5-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carboxamide;N,N-dimethyl-4-[3-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-5-yl]benzamide;2-methyl-1-[5-[1-(4-nitrophenyl)-3-phenylpyrazol-5-yl]thiophen-2-yl]propan-1-one?

The InChIKey is NFOCNFQMLLVLDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O3S.C20H15F6N3O.C16H18F3N3OS.2C16H18F3N3O.C14H16F3N3OS/c1-15(2)23(27)22-13-12-21(30-22)20-14-19(16-6-4-3-5-7-16)24-25(20)17-8-10-18(11-9-17)26(28)29;1-28(2)18(30)13-5-3-12(4-6-13)16-11-17(20(24,25)26)27-29(16)15-9-7-14(8-10-15)19(21,22)23;1-21(2)15(23)13-8-7-12(24-13)11-9-14(16(17,18)19)22(20-11)10-5-3-4-6-10;1-10(2)22-14(16(17,18)19)9-13(20-22)11-6-5-7-12(8-11)15(23)21(3)4;1-4-9-22-13(10-14(20-22)16(17,18)19)11-5-7-12(8-6-11)15(23)21(2)3;1-4-7-20-9(8-12(18-20)14(15,16)17)10-5-6-11(22-10)13(21)19(2)3/h3-15H,1-2H3;3-11H,1-2H3;7-10H,3-6H2,1-2H3;5-10H,1-4H3;5-8,10H,4,9H2,1-3H3;5-6,8H,4,7H2,1-3H3.

What are the key properties of 5-[1-cyclopentyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylthiophene-2-carboxamide;N,N-dimethyl-3-[1-propan-2-yl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-5-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carboxamide;N,N-dimethyl-4-[3-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-5-yl]benzamide;2-methyl-1-[5-[1-(4-nitrophenyl)-3-phenylpyrazol-5-yl]thiophen-2-yl]propan-1-one?

5-[1-cyclopentyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylthiophene-2-carboxamide;N,N-dimethyl-3-[1-propan-2-yl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-5-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carboxamide;N,N-dimethyl-4-[3-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-5-yl]benzamide;2-methyl-1-[5-[1-(4-nitrophenyl)-3-phenylpyrazol-5-yl]thiophen-2-yl]propan-1-one has a molecular weight of 2184.27 g/mol, XLogP of 27.02, 23 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[1-cyclopentyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylthiophene-2-carboxamide;N,N-dimethyl-3-[1-propan-2-yl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-5-[1-propyl-3-(trifluoromethyl)pyrazol-5-yl]thiophene-2-carboxamide;N,N-dimethyl-4-[3-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyrazol-5-yl]benzamide;2-methyl-1-[5-[1-(4-nitrophenyl)-3-phenylpyrazol-5-yl]thiophen-2-yl]propan-1-one is sourced from PubChem (CID 159766411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).