4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,4-dimethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3-methyl-2H-pyrrole-4-carboxamide

C110H75Cl8F12N19O18 — CID 159378521

About 4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,4-dimethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3-methyl-2H-pyrrole-4-carboxamide

4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,4-dimethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3-methyl-2H-pyrrole-4-carboxamide (PubChem CID 159378521) has the molecular formula C110H75Cl8F12N19O18 and a molecular weight of 2462.52 g/mol. Its IUPAC name is 4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,4-dimethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3-methyl-2H-pyrrole-4-carboxamide.

Molecular Properties

• Compound Name: 4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,4-dimethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3-methyl-2H-pyrrole-4-carboxamide
• PubChem CID: 159378521
• Molecular Formula: C110H75Cl8F12N19O18
• Molecular Weight: 2462.52 g/mol
• Exact Mass: 2457.29
• IUPAC Name: 4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,4-dimethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3-methyl-2H-pyrrole-4-carboxamide
• SMILES: CC1=C(C(=O)Nc2ccc(-c3cc4c(cc3Cl)OC(F)(F)O4)cn2)C=NC1.CC1=NCC(C)=C1C(=O)Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.CCn1cccc1C(=O)Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.Cc1cc(C(=O)Nc2ccc(-c3cc4c(cc3Cl)OC(F)(F)O4)cn2)n(C)c1.Cn1cc(Cl)c(C(=O)Nc2ccc(-c3cc4c(cc3Cl)OC(F)(F)O4)cn2)n1.Cn1ccc(Cl)c1C(=O)Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1
• InChI: InChI=1S/3C19H14ClF2N3O3.C18H11Cl2F2N3O3.C18H12ClF2N3O3.C17H10Cl2F2N4O3/c1-10-5-14(25(2)9-10)18(26)24-17-4-3-11(8-23-17)12-6-15-16(7-13(12)20)28-19(21,22)27-15;1-9-7-23-10(2)17(9)18(26)25-16-4-3-11(8-24-16)12-5-14-15(6-13(12)20)28-19(21,22)27-14;1-2-25-7-3-4-14(25)18(26)24-17-6-5-11(10-23-17)12-8-15-16(9-13(12)20)28-19(21,22)27-15;1-25-5-4-11(19)16(25)17(26)24-15-3-2-9(8-23-15)10-6-13-14(7-12(10)20)28-18(21,22)27-13;1-9-6-22-8-12(9)17(25)24-16-3-2-10(7-23-16)11-4-14-15(5-13(11)19)27-18(20,21)26-14;1-25-7-11(19)15(24-25)16(26)23-14-3-2-8(6-22-14)9-4-12-13(5-10(9)18)28-17(20,21)27-12/h3-9H,1-2H3,(H,23,24,26);3-6,8H,7H2,1-2H3,(H,24,25,26);3-10H,2H2,1H3,(H,23,24,26);2-8H,1H3,(H,23,24,26);2-5,7-8H,6H2,1H3,(H,23,24,25);2-7H,1H3,(H,22,23,26)
• InChIKey: LKPRHOKGBHSNFW-UHFFFAOYSA-N
• XLogP: 27.27
• TPSA: 420.03 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 31
• Rotatable Bonds: 19
• Heavy Atoms: 167
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2462.52
LogP ≤ 5	27.27
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,4-dimethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3-methyl-2H-pyrrole-4-carboxamide?

The IUPAC name of 4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,4-dimethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3-methyl-2H-pyrrole-4-carboxamide (CID 159378521) is 4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,4-dimethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3-methyl-2H-pyrrole-4-carboxamide.

What is the SMILES notation for 4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,4-dimethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3-methyl-2H-pyrrole-4-carboxamide?

The canonical SMILES for 4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,4-dimethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3-methyl-2H-pyrrole-4-carboxamide is CC1=C(C(=O)Nc2ccc(-c3cc4c(cc3Cl)OC(F)(F)O4)cn2)C=NC1.CC1=NCC(C)=C1C(=O)Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.CCn1cccc1C(=O)Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.Cc1cc(C(=O)Nc2ccc(-c3cc4c(cc3Cl)OC(F)(F)O4)cn2)n(C)c1.Cn1cc(Cl)c(C(=O)Nc2ccc(-c3cc4c(cc3Cl)OC(F)(F)O4)cn2)n1.Cn1ccc(Cl)c1C(=O)Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.

What is the InChIKey of 4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,4-dimethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3-methyl-2H-pyrrole-4-carboxamide?

The InChIKey is LKPRHOKGBHSNFW-UHFFFAOYSA-N. The full InChI is InChI=1S/3C19H14ClF2N3O3.C18H11Cl2F2N3O3.C18H12ClF2N3O3.C17H10Cl2F2N4O3/c1-10-5-14(25(2)9-10)18(26)24-17-4-3-11(8-23-17)12-6-15-16(7-13(12)20)28-19(21,22)27-15;1-9-7-23-10(2)17(9)18(26)25-16-4-3-11(8-24-16)12-5-14-15(6-13(12)20)28-19(21,22)27-14;1-2-25-7-3-4-14(25)18(26)24-17-6-5-11(10-23-17)12-8-15-16(9-13(12)20)28-19(21,22)27-15;1-25-5-4-11(19)16(25)17(26)24-15-3-2-9(8-23-15)10-6-13-14(7-12(10)20)28-18(21,22)27-13;1-9-6-22-8-12(9)17(25)24-16-3-2-10(7-23-16)11-4-14-15(5-13(11)19)27-18(20,21)26-14;1-25-7-11(19)15(24-25)16(26)23-14-3-2-8(6-22-14)9-4-12-13(5-10(9)18)28-17(20,21)27-12/h3-9H,1-2H3,(H,23,24,26);3-6,8H,7H2,1-2H3,(H,24,25,26);3-10H,2H2,1H3,(H,23,24,26);2-8H,1H3,(H,23,24,26);2-5,7-8H,6H2,1H3,(H,23,24,25);2-7H,1H3,(H,22,23,26).

What are the key properties of 4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,4-dimethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3-methyl-2H-pyrrole-4-carboxamide?

4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,4-dimethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3-methyl-2H-pyrrole-4-carboxamide has a molecular weight of 2462.52 g/mol, XLogP of 27.27, 19 rotatable bonds, 6 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1,4-dimethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-3-methyl-2H-pyrrole-4-carboxamide is sourced from PubChem (CID 159378521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).