6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine;6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N,2-dimethyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-5-amine;2-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethoxy)anilino]pyridine-4-carbonitrile

C95H68Cl2F18N26O4 — CID 158527698

About 6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine;6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N,2-dimethyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-5-amine;2-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethoxy)anilino]pyridine-4-carbonitrile

6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine;6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N,2-dimethyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-5-amine;2-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethoxy)anilino]pyridine-4-carbonitrile (PubChem CID 158527698) has the molecular formula C95H68Cl2F18N26O4 and a molecular weight of 2050.64 g/mol. Its IUPAC name is 6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine;6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N,2-dimethyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-5-amine;2-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethoxy)anilino]pyridine-4-carbonitrile.

Molecular Properties

• Compound Name: 6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine;6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N,2-dimethyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-5-amine;2-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethoxy)anilino]pyridine-4-carbonitrile
• PubChem CID: 158527698
• Molecular Formula: C95H68Cl2F18N26O4
• Molecular Weight: 2050.64 g/mol
• Exact Mass: 2048.50
• IUPAC Name: 6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine;6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N,2-dimethyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-5-amine;2-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethoxy)anilino]pyridine-4-carbonitrile
• SMILES: CNc1ccc2c(c1)nc(C)n2-c1cncc(Nc2ccc(OC(F)(F)F)cc2)n1.Cc1n[nH]c(C)c1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1nc2cc(Cl)ccc2n1-c1cncc(Nc2ccc(OC(F)(F)F)cc2)n1.Cc1nc2cc(Cl)ccc2n1-c1cncc(Nc2ccc(OC(F)F)cc2)n1.N#Cc1cc(Nc2ccc(OC(F)(F)F)cc2)nc(-c2c(C(F)(F)F)nc3ccc(F)cn23)c1
• InChI: InChI=1S/C21H10F7N5O.C20H17F3N6O.C19H13ClF3N5O.C19H14ClF2N5O.C16H14F3N5/c22-12-1-6-17-32-19(20(23,24)25)18(33(17)10-12)15-7-11(9-29)8-16(31-15)30-13-2-4-14(5-3-13)34-21(26,27)28;1-12-26-16-9-14(24-2)5-8-17(16)29(12)19-11-25-10-18(28-19)27-13-3-6-15(7-4-13)30-20(21,22)23;1-11-25-15-8-12(20)2-7-16(15)28(11)18-10-24-9-17(27-18)26-13-3-5-14(6-4-13)29-19(21,22)23;1-11-24-15-8-12(20)2-7-16(15)27(11)18-10-23-9-17(26-18)25-13-3-5-14(6-4-13)28-19(21)22;1-9-15(10(2)24-23-9)13-7-20-8-14(22-13)21-12-5-3-11(4-6-12)16(17,18)19/h1-8,10H,(H,30,31);3-11,24H,1-2H3,(H,27,28);2-10H,1H3,(H,26,27);2-10,19H,1H3,(H,25,26);3-8H,1-2H3,(H,21,22)(H,23,24)
• InChIKey: HMZFJWMGRAQGKI-UHFFFAOYSA-N
• XLogP: 25.66
• TPSA: 348.34 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 29
• Rotatable Bonds: 21
• Heavy Atoms: 145
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2050.64
LogP ≤ 5	25.66
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	29

Frequently Asked Questions

What is the IUPAC name of 6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine;6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N,2-dimethyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-5-amine;2-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethoxy)anilino]pyridine-4-carbonitrile?

The IUPAC name of 6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine;6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N,2-dimethyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-5-amine;2-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethoxy)anilino]pyridine-4-carbonitrile (CID 158527698) is 6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine;6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N,2-dimethyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-5-amine;2-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethoxy)anilino]pyridine-4-carbonitrile.

What is the SMILES notation for 6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine;6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N,2-dimethyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-5-amine;2-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethoxy)anilino]pyridine-4-carbonitrile?

The canonical SMILES for 6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine;6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N,2-dimethyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-5-amine;2-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethoxy)anilino]pyridine-4-carbonitrile is CNc1ccc2c(c1)nc(C)n2-c1cncc(Nc2ccc(OC(F)(F)F)cc2)n1.Cc1n[nH]c(C)c1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1nc2cc(Cl)ccc2n1-c1cncc(Nc2ccc(OC(F)(F)F)cc2)n1.Cc1nc2cc(Cl)ccc2n1-c1cncc(Nc2ccc(OC(F)F)cc2)n1.N#Cc1cc(Nc2ccc(OC(F)(F)F)cc2)nc(-c2c(C(F)(F)F)nc3ccc(F)cn23)c1.

What is the InChIKey of 6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine;6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N,2-dimethyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-5-amine;2-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethoxy)anilino]pyridine-4-carbonitrile?

The InChIKey is HMZFJWMGRAQGKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H10F7N5O.C20H17F3N6O.C19H13ClF3N5O.C19H14ClF2N5O.C16H14F3N5/c22-12-1-6-17-32-19(20(23,24)25)18(33(17)10-12)15-7-11(9-29)8-16(31-15)30-13-2-4-14(5-3-13)34-21(26,27)28;1-12-26-16-9-14(24-2)5-8-17(16)29(12)19-11-25-10-18(28-19)27-13-3-6-15(7-4-13)30-20(21,22)23;1-11-25-15-8-12(20)2-7-16(15)28(11)18-10-24-9-17(27-18)26-13-3-5-14(6-4-13)29-19(21,22)23;1-11-24-15-8-12(20)2-7-16(15)27(11)18-10-23-9-17(26-18)25-13-3-5-14(6-4-13)28-19(21)22;1-9-15(10(2)24-23-9)13-7-20-8-14(22-13)21-12-5-3-11(4-6-12)16(17,18)19/h1-8,10H,(H,30,31);3-11,24H,1-2H3,(H,27,28);2-10H,1H3,(H,26,27);2-10,19H,1H3,(H,25,26);3-8H,1-2H3,(H,21,22)(H,23,24).

What are the key properties of 6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine;6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N,2-dimethyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-5-amine;2-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethoxy)anilino]pyridine-4-carbonitrile?

6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine;6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N,2-dimethyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-5-amine;2-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethoxy)anilino]pyridine-4-carbonitrile has a molecular weight of 2050.64 g/mol, XLogP of 25.66, 21 rotatable bonds, 7 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine;6-(5-chloro-2-methylbenzimidazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine;6-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;N,2-dimethyl-1-[6-[4-(trifluoromethoxy)anilino]pyrazin-2-yl]benzimidazol-5-amine;2-[6-fluoro-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethoxy)anilino]pyridine-4-carbonitrile is sourced from PubChem (CID 158527698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).