N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]cyclopent-3-ene-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-(4-methylphenyl)cyclobutane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]pentanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopentane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopropane-1-carboxamide

C136H107Cl7F14N16O21 — CID 157326016

About N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]cyclopent-3-ene-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-(4-methylphenyl)cyclobutane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]pentanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopentane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopropane-1-carboxamide

N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]cyclopent-3-ene-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-(4-methylphenyl)cyclobutane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]pentanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopentane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopropane-1-carboxamide (PubChem CID 157326016) has the molecular formula C136H107Cl7F14N16O21 and a molecular weight of 2815.59 g/mol. Its IUPAC name is N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]cyclopent-3-ene-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-(4-methylphenyl)cyclobutane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]pentanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopentane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopropane-1-carboxamide.

Molecular Properties

• Compound Name: N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]cyclopent-3-ene-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-(4-methylphenyl)cyclobutane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]pentanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopentane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopropane-1-carboxamide
• PubChem CID: 157326016
• Molecular Formula: C136H107Cl7F14N16O21
• Molecular Weight: 2815.59 g/mol
• Exact Mass: 2810.54
• IUPAC Name: N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]cyclopent-3-ene-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-(4-methylphenyl)cyclobutane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]pentanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopentane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopropane-1-carboxamide
• SMILES: CC(C)(C)C(=O)Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.CC(C)C(=O)Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.CCCCC(=O)Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.Cc1ccc(C2(C(=O)Nc3ccc(-c4cc5c(cc4Cl)OC(F)(F)O5)cn3)CCC2)cc1.O=C(Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)C1(c2ccccc2)CC1.O=C(Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)C1(c2ccccc2)CCCC1.O=C(Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)C1CC=CC1
• InChI: InChI=1S/2C24H19ClF2N2O3.C22H15ClF2N2O3.C17H12ClF2N3O3.2C17H15ClF2N2O3.C15H12ClF2N3O3/c1-14-3-6-16(7-4-14)23(9-2-10-23)22(30)29-21-8-5-15(13-28-21)17-11-19-20(12-18(17)25)32-24(26,27)31-19;25-18-13-20-19(31-24(26,27)32-20)12-17(18)15-8-9-21(28-14-15)29-22(30)23(10-4-5-11-23)16-6-2-1-3-7-16;23-16-11-18-17(29-22(24,25)30-18)10-15(16)13-6-7-19(26-12-13)27-20(28)21(8-9-21)14-4-2-1-3-5-14;18-11-6-14-13(25-17(19,20)26-14)5-10(11)12-7-22-15(8-21-12)23-16(24)9-3-1-2-4-9;1-16(2,3)15(23)22-14-5-4-9(8-21-14)10-6-12-13(7-11(10)18)25-17(19,20)24-12;1-2-3-4-16(23)22-15-6-5-10(9-21-15)11-7-13-14(8-12(11)18)25-17(19,20)24-13;1-7(2)14(22)21-13-6-19-10(5-20-13)8-3-11-12(4-9(8)16)24-15(17,18)23-11/h3-8,11-13H,2,9-10H2,1H3,(H,28,29,30);1-3,6-9,12-14H,4-5,10-11H2,(H,28,29,30);1-7,10-12H,8-9H2,(H,26,27,28);1-2,5-9H,3-4H2,(H,22,23,24);4-8H,1-3H3,(H,21,22,23);5-9H,2-4H2,1H3,(H,21,22,23);3-7H,1-2H3,(H,20,21,22)
• InChIKey: BESNZQUSHDGCNW-UHFFFAOYSA-N
• XLogP: 34.96
• TPSA: 448.93 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 30
• Rotatable Bonds: 25
• Heavy Atoms: 194
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2815.59
LogP ≤ 5	34.96
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]cyclopent-3-ene-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-(4-methylphenyl)cyclobutane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]pentanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopentane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopropane-1-carboxamide?

The IUPAC name of N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]cyclopent-3-ene-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-(4-methylphenyl)cyclobutane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]pentanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopentane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopropane-1-carboxamide (CID 157326016) is N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]cyclopent-3-ene-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-(4-methylphenyl)cyclobutane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]pentanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopentane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopropane-1-carboxamide.

What is the SMILES notation for N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]cyclopent-3-ene-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-(4-methylphenyl)cyclobutane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]pentanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopentane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopropane-1-carboxamide?

The canonical SMILES for N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]cyclopent-3-ene-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-(4-methylphenyl)cyclobutane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]pentanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopentane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopropane-1-carboxamide is CC(C)(C)C(=O)Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.CC(C)C(=O)Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.CCCCC(=O)Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.Cc1ccc(C2(C(=O)Nc3ccc(-c4cc5c(cc4Cl)OC(F)(F)O5)cn3)CCC2)cc1.O=C(Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)C1(c2ccccc2)CC1.O=C(Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)C1(c2ccccc2)CCCC1.O=C(Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)C1CC=CC1.

What is the InChIKey of N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]cyclopent-3-ene-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-(4-methylphenyl)cyclobutane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]pentanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopentane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopropane-1-carboxamide?

The InChIKey is BESNZQUSHDGCNW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C24H19ClF2N2O3.C22H15ClF2N2O3.C17H12ClF2N3O3.2C17H15ClF2N2O3.C15H12ClF2N3O3/c1-14-3-6-16(7-4-14)23(9-2-10-23)22(30)29-21-8-5-15(13-28-21)17-11-19-20(12-18(17)25)32-24(26,27)31-19;25-18-13-20-19(31-24(26,27)32-20)12-17(18)15-8-9-21(28-14-15)29-22(30)23(10-4-5-11-23)16-6-2-1-3-7-16;23-16-11-18-17(29-22(24,25)30-18)10-15(16)13-6-7-19(26-12-13)27-20(28)21(8-9-21)14-4-2-1-3-5-14;18-11-6-14-13(25-17(19,20)26-14)5-10(11)12-7-22-15(8-21-12)23-16(24)9-3-1-2-4-9;1-16(2,3)15(23)22-14-5-4-9(8-21-14)10-6-12-13(7-11(10)18)25-17(19,20)24-12;1-2-3-4-16(23)22-15-6-5-10(9-21-15)11-7-13-14(8-12(11)18)25-17(19,20)24-13;1-7(2)14(22)21-13-6-19-10(5-20-13)8-3-11-12(4-9(8)16)24-15(17,18)23-11/h3-8,11-13H,2,9-10H2,1H3,(H,28,29,30);1-3,6-9,12-14H,4-5,10-11H2,(H,28,29,30);1-7,10-12H,8-9H2,(H,26,27,28);1-2,5-9H,3-4H2,(H,22,23,24);4-8H,1-3H3,(H,21,22,23);5-9H,2-4H2,1H3,(H,21,22,23);3-7H,1-2H3,(H,20,21,22).

What are the key properties of N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]cyclopent-3-ene-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-(4-methylphenyl)cyclobutane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]pentanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopentane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopropane-1-carboxamide?

N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]cyclopent-3-ene-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-(4-methylphenyl)cyclobutane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]pentanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopentane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopropane-1-carboxamide has a molecular weight of 2815.59 g/mol, XLogP of 34.96, 25 rotatable bonds, 7 hydrogen bond donors, and 30 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]cyclopent-3-ene-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-(4-methylphenyl)cyclobutane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]pentanamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopentane-1-carboxamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)-2-pyridinyl]-1-phenylcyclopropane-1-carboxamide is sourced from PubChem (CID 157326016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).