N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide

C91H63ClF16N26O6 — CID 158419041

About N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide

N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide (PubChem CID 158419041) has the molecular formula C91H63ClF16N26O6 and a molecular weight of 1956.10 g/mol. Its IUPAC name is N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide.

Molecular Properties

• Compound Name: N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
• PubChem CID: 158419041
• Molecular Formula: C91H63ClF16N26O6
• Molecular Weight: 1956.10 g/mol
• Exact Mass: 1954.49
• IUPAC Name: N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
• SMILES: CC1=NC(C)=C(C(=O)Nc2cn[nH]c2-c2nc3ccccc3[nH]2)C1.Cc1cc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc2cc1Cl.Cc1cccc(F)c1C(=O)Nc1cn[nH]c1-c1nc2c(C)cc(C(F)(F)F)cc2[nH]1.O=C(Nc1cn[nH]c1-c1nc2c(C(F)(F)F)cc(C(F)(F)F)cc2[nH]1)c1c(F)cccc1F.O=C(Nc1cn[nH]c1-c1nc2ccc(O)cc2[nH]1)c1c(F)cccc1F
• InChI: InChI=1S/C20H15F4N5O.C19H9F8N5O.C18H12ClF2N5O.C17H11F2N5O2.C17H16N6O/c1-9-4-3-5-12(21)15(9)19(30)27-14-8-25-29-17(14)18-26-13-7-11(20(22,23)24)6-10(2)16(13)28-18;20-9-2-1-3-10(21)13(9)17(33)30-12-6-28-32-15(12)16-29-11-5-7(18(22,23)24)4-8(14(11)31-16)19(25,26)27;1-8-5-12-13(6-9(8)19)24-17(23-12)16-14(7-22-26-16)25-18(27)15-10(20)3-2-4-11(15)21;18-9-2-1-3-10(19)14(9)17(26)23-13-7-20-24-15(13)16-21-11-5-4-8(25)6-12(11)22-16;1-9-7-11(10(2)19-9)17(24)22-14-8-18-23-15(14)16-20-12-5-3-4-6-13(12)21-16/h3-8H,1-2H3,(H,25,29)(H,26,28)(H,27,30);1-6H,(H,28,32)(H,29,31)(H,30,33);2-7H,1H3,(H,22,26)(H,23,24)(H,25,27);1-7,25H,(H,20,24)(H,21,22)(H,23,26);3-6,8H,7H2,1-2H3,(H,18,23)(H,20,21)(H,22,24)
• InChIKey: HAGMMDCAKBQBDC-UHFFFAOYSA-N
• XLogP: 21.17
• TPSA: 464.89 Ų
• H-Bond Donors: 16
• H-Bond Acceptors: 17
• Rotatable Bonds: 15
• Heavy Atoms: 140
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1956.10
LogP ≤ 5	21.17
H-Bond Donors ≤ 5	16
H-Bond Acceptors ≤ 10	17

Frequently Asked Questions

What is the IUPAC name of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide?

The IUPAC name of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide (CID 158419041) is N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide.

What is the SMILES notation for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide?

The canonical SMILES for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide is CC1=NC(C)=C(C(=O)Nc2cn[nH]c2-c2nc3ccccc3[nH]2)C1.Cc1cc2[nH]c(-c3[nH]ncc3NC(=O)c3c(F)cccc3F)nc2cc1Cl.Cc1cccc(F)c1C(=O)Nc1cn[nH]c1-c1nc2c(C)cc(C(F)(F)F)cc2[nH]1.O=C(Nc1cn[nH]c1-c1nc2c(C(F)(F)F)cc(C(F)(F)F)cc2[nH]1)c1c(F)cccc1F.O=C(Nc1cn[nH]c1-c1nc2ccc(O)cc2[nH]1)c1c(F)cccc1F.

What is the InChIKey of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide?

The InChIKey is HAGMMDCAKBQBDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F4N5O.C19H9F8N5O.C18H12ClF2N5O.C17H11F2N5O2.C17H16N6O/c1-9-4-3-5-12(21)15(9)19(30)27-14-8-25-29-17(14)18-26-13-7-11(20(22,23)24)6-10(2)16(13)28-18;20-9-2-1-3-10(21)13(9)17(33)30-12-6-28-32-15(12)16-29-11-5-7(18(22,23)24)4-8(14(11)31-16)19(25,26)27;1-8-5-12-13(6-9(8)19)24-17(23-12)16-14(7-22-26-16)25-18(27)15-10(20)3-2-4-11(15)21;18-9-2-1-3-10(19)14(9)17(26)23-13-7-20-24-15(13)16-21-11-5-4-8(25)6-12(11)22-16;1-9-7-11(10(2)19-9)17(24)22-14-8-18-23-15(14)16-20-12-5-3-4-6-13(12)21-16/h3-8H,1-2H3,(H,25,29)(H,26,28)(H,27,30);1-6H,(H,28,32)(H,29,31)(H,30,33);2-7H,1H3,(H,22,26)(H,23,24)(H,25,27);1-7,25H,(H,20,24)(H,21,22)(H,23,26);3-6,8H,7H2,1-2H3,(H,18,23)(H,20,21)(H,22,24).

What are the key properties of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide?

N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide has a molecular weight of 1956.10 g/mol, XLogP of 21.17, 15 rotatable bonds, 16 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]-2,5-dimethyl-3H-pyrrole-4-carboxamide;N-[5-[4,6-bis(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;N-[5-(5-chloro-6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-(6-hydroxy-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide;2-fluoro-6-methyl-N-[5-[4-methyl-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide is sourced from PubChem (CID 158419041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).