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

C107H76Cl5F13N24O18 — CID 158137710

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

N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-(1-fluoroethyl)pyrazole-3-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3-methyl-2H-pyrrole-4-carboxamide;3-chloro-N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-methylpyrrole-2-carboxamide;N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide (PubChem CID 158137710) has the molecular formula C107H76Cl5F13N24O18 and a molecular weight of 2410.17 g/mol. Its IUPAC name is N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-(1-fluoroethyl)pyrazole-3-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3-methyl-2H-pyrrole-4-carboxamide;3-chloro-N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-methylpyrrole-2-carboxamide;N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide.

Molecular Properties

• Compound Name: N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-(1-fluoroethyl)pyrazole-3-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3-methyl-2H-pyrrole-4-carboxamide;3-chloro-N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-methylpyrrole-2-carboxamide;N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide
• PubChem CID: 158137710
• Molecular Formula: C107H76Cl5F13N24O18
• Molecular Weight: 2410.17 g/mol
• Exact Mass: 2406.40
• IUPAC Name: N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-(1-fluoroethyl)pyrazole-3-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3-methyl-2H-pyrrole-4-carboxamide;3-chloro-N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-methylpyrrole-2-carboxamide;N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide
• SMILES: CC(F)n1nccc1C(=O)Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.CC1=C(C(=O)Nc2cnc(-c3cc4c(cc3Cl)OC(F)(F)O4)cn2)C=NC1.CC1=NCC(C)=C1C(=O)Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.CCn1cccc1C(=O)Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.Cc1cc2c(cc1-c1ccc(NC(=O)c3cccn3C)nc1)OC(F)(F)O2.Cc1cc2c(cc1-c1cnc(NC(=O)c3c(Cl)ccn3C)cn1)OC(F)(F)O2
• InChI: InChI=1S/C19H15F2N3O3.3C18H13ClF2N4O3.C17H11ClF3N5O3.C17H11ClF2N4O3/c1-11-8-15-16(27-19(20,21)26-15)9-13(11)12-5-6-17(22-10-12)23-18(25)14-4-3-7-24(14)2;1-8-5-22-9(2)16(8)17(26)25-15-7-23-12(6-24-15)10-3-13-14(4-11(10)19)28-18(20,21)27-13;1-9-5-13-14(28-18(20,21)27-13)6-10(9)12-7-23-15(8-22-12)24-17(26)16-11(19)3-4-25(16)2;1-2-25-5-3-4-13(25)17(26)24-16-9-22-12(8-23-16)10-6-14-15(7-11(10)19)28-18(20,21)27-14;1-8(19)26-12(2-3-24-26)16(27)25-15-7-22-11(6-23-15)9-4-13-14(5-10(9)18)29-17(20,21)28-13;1-8-4-21-5-10(8)16(25)24-15-7-22-12(6-23-15)9-2-13-14(3-11(9)18)27-17(19,20)26-13/h3-10H,1-2H3,(H,22,23,25);3-4,6-7H,5H2,1-2H3,(H,24,25,26);3-8H,1-2H3,(H,23,24,26);3-9H,2H2,1H3,(H,23,24,26);2-8H,1H3,(H,23,25,27);2-3,5-7H,4H2,1H3,(H,23,24,25)
• InChIKey: FTOAGAADVHWOTJ-UHFFFAOYSA-N
• XLogP: 23.54
• TPSA: 484.48 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 36
• Rotatable Bonds: 20
• Heavy Atoms: 167
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2410.17
LogP ≤ 5	23.54
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	36

Frequently Asked Questions

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

The IUPAC name of N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-(1-fluoroethyl)pyrazole-3-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3-methyl-2H-pyrrole-4-carboxamide;3-chloro-N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-methylpyrrole-2-carboxamide;N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide (CID 158137710) is N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-(1-fluoroethyl)pyrazole-3-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3-methyl-2H-pyrrole-4-carboxamide;3-chloro-N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-methylpyrrole-2-carboxamide;N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide.

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

The canonical SMILES for N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-(1-fluoroethyl)pyrazole-3-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3-methyl-2H-pyrrole-4-carboxamide;3-chloro-N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-methylpyrrole-2-carboxamide;N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide is CC(F)n1nccc1C(=O)Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.CC1=C(C(=O)Nc2cnc(-c3cc4c(cc3Cl)OC(F)(F)O4)cn2)C=NC1.CC1=NCC(C)=C1C(=O)Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.CCn1cccc1C(=O)Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.Cc1cc2c(cc1-c1ccc(NC(=O)c3cccn3C)nc1)OC(F)(F)O2.Cc1cc2c(cc1-c1cnc(NC(=O)c3c(Cl)ccn3C)cn1)OC(F)(F)O2.

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

The InChIKey is FTOAGAADVHWOTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2N3O3.3C18H13ClF2N4O3.C17H11ClF3N5O3.C17H11ClF2N4O3/c1-11-8-15-16(27-19(20,21)26-15)9-13(11)12-5-6-17(22-10-12)23-18(25)14-4-3-7-24(14)2;1-8-5-22-9(2)16(8)17(26)25-15-7-23-12(6-24-15)10-3-13-14(4-11(10)19)28-18(20,21)27-13;1-9-5-13-14(28-18(20,21)27-13)6-10(9)12-7-23-15(8-22-12)24-17(26)16-11(19)3-4-25(16)2;1-2-25-5-3-4-13(25)17(26)24-16-9-22-12(8-23-16)10-6-14-15(7-11(10)19)28-18(20,21)27-14;1-8(19)26-12(2-3-24-26)16(27)25-15-7-22-11(6-23-15)9-4-13-14(5-10(9)18)29-17(20,21)28-13;1-8-4-21-5-10(8)16(25)24-15-7-22-12(6-23-15)9-2-13-14(3-11(9)18)27-17(19,20)26-13/h3-10H,1-2H3,(H,22,23,25);3-4,6-7H,5H2,1-2H3,(H,24,25,26);3-8H,1-2H3,(H,23,24,26);3-9H,2H2,1H3,(H,23,24,26);2-8H,1H3,(H,23,25,27);2-3,5-7H,4H2,1H3,(H,23,24,25).

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

N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-(1-fluoroethyl)pyrazole-3-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3-methyl-2H-pyrrole-4-carboxamide;3-chloro-N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-methylpyrrole-2-carboxamide;N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide has a molecular weight of 2410.17 g/mol, XLogP of 23.54, 20 rotatable bonds, 6 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3,5-dimethyl-2H-pyrrole-4-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-ethylpyrrole-2-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-(1-fluoroethyl)pyrazole-3-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-3-methyl-2H-pyrrole-4-carboxamide;3-chloro-N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]-1-methylpyrrole-2-carboxamide;N-[5-(2,2-difluoro-6-methyl-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-methylpyrrole-2-carboxamide is sourced from PubChem (CID 158137710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).