N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide

C65H52F2N22O6S — CID 158587297

About N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide

N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide (PubChem CID 158587297) has the molecular formula C65H52F2N22O6S and a molecular weight of 1307.34 g/mol. Its IUPAC name is N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide.

Molecular Properties

• Compound Name: N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide
• PubChem CID: 158587297
• Molecular Formula: C65H52F2N22O6S
• Molecular Weight: 1307.34 g/mol
• Exact Mass: 1306.41
• IUPAC Name: N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide
• SMILES: Cc1ccc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc2c1C.Cc1noc(C)c1C(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1.Cc1occc1C(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1.O=C(Nc1cn[nH]c1-c1nc2ccccc2[nH]1)c1nccs1
• InChI: InChI=1S/C19H15F2N5O.C16H14N6O2.C16H13N5O2.C14H10N6OS/c1-9-6-7-13-16(10(9)2)25-18(23-13)17-14(8-22-26-17)24-19(27)15-11(20)4-3-5-12(15)21;1-8-13(9(2)24-22-8)16(23)20-12-7-17-21-14(12)15-18-10-5-3-4-6-11(10)19-15;1-9-10(6-7-23-9)16(22)20-13-8-17-21-14(13)15-18-11-4-2-3-5-12(11)19-15;21-13(14-15-5-6-22-14)19-10-7-16-20-11(10)12-17-8-3-1-2-4-9(8)18-12/h3-8H,1-2H3,(H,22,26)(H,23,25)(H,24,27);3-7H,1-2H3,(H,17,21)(H,18,19)(H,20,23);2-8H,1H3,(H,17,21)(H,18,19)(H,20,22);1-7H,(H,16,20)(H,17,18)(H,19,21)
• InChIKey: HTZHRYWNMSXHBW-UHFFFAOYSA-N
• XLogP: 12.68
• TPSA: 397.90 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 17
• Rotatable Bonds: 12
• Heavy Atoms: 96
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1307.34
LogP ≤ 5	12.68
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	17

Frequently Asked Questions

What is the IUPAC name of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide?

The IUPAC name of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide (CID 158587297) is N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide.

What is the SMILES notation for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide?

The canonical SMILES for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide is Cc1ccc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc2c1C.Cc1noc(C)c1C(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1.Cc1occc1C(=O)Nc1cn[nH]c1-c1nc2ccccc2[nH]1.O=C(Nc1cn[nH]c1-c1nc2ccccc2[nH]1)c1nccs1.

What is the InChIKey of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide?

The InChIKey is HTZHRYWNMSXHBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2N5O.C16H14N6O2.C16H13N5O2.C14H10N6OS/c1-9-6-7-13-16(10(9)2)25-18(23-13)17-14(8-22-26-17)24-19(27)15-11(20)4-3-5-12(15)21;1-8-13(9(2)24-22-8)16(23)20-12-7-17-21-14(12)15-18-10-5-3-4-6-11(10)19-15;1-9-10(6-7-23-9)16(22)20-13-8-17-21-14(13)15-18-11-4-2-3-5-12(11)19-15;21-13(14-15-5-6-22-14)19-10-7-16-20-11(10)12-17-8-3-1-2-4-9(8)18-12/h3-8H,1-2H3,(H,22,26)(H,23,25)(H,24,27);3-7H,1-2H3,(H,17,21)(H,18,19)(H,20,23);2-8H,1H3,(H,17,21)(H,18,19)(H,20,22);1-7H,(H,16,20)(H,17,18)(H,19,21).

What are the key properties of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide?

N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide has a molecular weight of 1307.34 g/mol, XLogP of 12.68, 12 rotatable bonds, 12 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methylfuran-3-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1,3-thiazole-2-carboxamide;N-[5-(4,5-dimethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide is sourced from PubChem (CID 158587297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).