N-(1H-benzimidazol-2-ylmethyl)-7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(oxolan-2-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-piperazin-1-ylmethanone;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1,3-thiazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide

C148H132Cl4F6N26O10S — CID 162242276

About N-(1H-benzimidazol-2-ylmethyl)-7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(oxolan-2-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-piperazin-1-ylmethanone;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1,3-thiazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide

N-(1H-benzimidazol-2-ylmethyl)-7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(oxolan-2-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-piperazin-1-ylmethanone;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1,3-thiazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide (PubChem CID 162242276) has the molecular formula C148H132Cl4F6N26O10S and a molecular weight of 2722.72 g/mol. Its IUPAC name is N-(1H-benzimidazol-2-ylmethyl)-7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(oxolan-2-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-piperazin-1-ylmethanone;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1,3-thiazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: N-(1H-benzimidazol-2-ylmethyl)-7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(oxolan-2-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-piperazin-1-ylmethanone;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1,3-thiazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
• PubChem CID: 162242276
• Molecular Formula: C148H132Cl4F6N26O10S
• Molecular Weight: 2722.72 g/mol
• Exact Mass: 2718.90
• IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(oxolan-2-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-piperazin-1-ylmethanone;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1,3-thiazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
• SMILES: C=C1C=Cc2cc(C(=O)N3CCNCC3)[nH]c2N1c1ccc(Cl)cc1.C=C1C=Cc2cc(C(=O)NCC3CCCO3)[nH]c2N1c1ccc(Cl)cc1.C=C1C=Cc2cc(C(=O)NCCN3CCCC3)[nH]c2N1c1ccc(Cl)cc1.C=C1C=Cc2cc(C(=O)NCc3nc4ccccc4[nH]3)[nH]c2N1c1ccc(Cl)cc1.C=C1C=Cc2cc(C(=O)Nc3ccc(Oc4ccccc4)cc3)[nH]c2N1c1ccc(C(F)(F)F)cc1.C=C1C=Cc2cc(C(=O)Nc3nccs3)[nH]c2N1c1ccc(C(F)(F)F)cc1.C=C1C=Cc2cc(C(N)=O)[nH]c2N1c1ccc(OC(C)C)cc1
• InChI: InChI=1S/C28H20F3N3O2.C23H18ClN5O.C21H23ClN4O.C20H20ClN3O2.C19H19ClN4O.C19H13F3N4OS.C18H19N3O2/c1-18-7-8-19-17-25(33-26(19)34(18)22-13-9-20(10-14-22)28(29,30)31)27(35)32-21-11-15-24(16-12-21)36-23-5-3-2-4-6-23;1-14-6-7-15-12-20(28-22(15)29(14)17-10-8-16(24)9-11-17)23(30)25-13-21-26-18-4-2-3-5-19(18)27-21;1-15-4-5-16-14-19(21(27)23-10-13-25-11-2-3-12-25)24-20(16)26(15)18-8-6-17(22)7-9-18;1-13-4-5-14-11-18(20(25)22-12-17-3-2-10-26-17)23-19(14)24(13)16-8-6-15(21)7-9-16;1-13-2-3-14-12-17(19(25)23-10-8-21-9-11-23)22-18(14)24(13)16-6-4-15(20)5-7-16;1-11-2-3-12-10-15(17(27)25-18-23-8-9-28-18)24-16(12)26(11)14-6-4-13(5-7-14)19(20,21)22;1-11(2)23-15-8-6-14(7-9-15)21-12(3)4-5-13-10-16(17(19)22)20-18(13)21/h2-17,33H,1H2,(H,32,35);2-12,28H,1,13H2,(H,25,30)(H,26,27);4-9,14,24H,1-3,10-13H2,(H,23,27);4-9,11,17,23H,1-3,10,12H2,(H,22,25);2-7,12,21-22H,1,8-11H2;2-10,24H,1H2,(H,23,25,27);4-11,20H,3H2,1-2H3,(H2,19,22)
• InChIKey: ZWVYWXASDLUZBR-UHFFFAOYSA-N
• XLogP: 33.73
• TPSA: 426.64 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 22
• Rotatable Bonds: 27
• Heavy Atoms: 195
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2722.72
LogP ≤ 5	33.73
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-2-ylmethyl)-7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(oxolan-2-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-piperazin-1-ylmethanone;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1,3-thiazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide?

The IUPAC name of N-(1H-benzimidazol-2-ylmethyl)-7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(oxolan-2-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-piperazin-1-ylmethanone;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1,3-thiazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide (CID 162242276) is N-(1H-benzimidazol-2-ylmethyl)-7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(oxolan-2-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-piperazin-1-ylmethanone;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1,3-thiazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide.

What is the SMILES notation for N-(1H-benzimidazol-2-ylmethyl)-7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(oxolan-2-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-piperazin-1-ylmethanone;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1,3-thiazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide?

The canonical SMILES for N-(1H-benzimidazol-2-ylmethyl)-7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(oxolan-2-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-piperazin-1-ylmethanone;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1,3-thiazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide is C=C1C=Cc2cc(C(=O)N3CCNCC3)[nH]c2N1c1ccc(Cl)cc1.C=C1C=Cc2cc(C(=O)NCC3CCCO3)[nH]c2N1c1ccc(Cl)cc1.C=C1C=Cc2cc(C(=O)NCCN3CCCC3)[nH]c2N1c1ccc(Cl)cc1.C=C1C=Cc2cc(C(=O)NCc3nc4ccccc4[nH]3)[nH]c2N1c1ccc(Cl)cc1.C=C1C=Cc2cc(C(=O)Nc3ccc(Oc4ccccc4)cc3)[nH]c2N1c1ccc(C(F)(F)F)cc1.C=C1C=Cc2cc(C(=O)Nc3nccs3)[nH]c2N1c1ccc(C(F)(F)F)cc1.C=C1C=Cc2cc(C(N)=O)[nH]c2N1c1ccc(OC(C)C)cc1.

What is the InChIKey of N-(1H-benzimidazol-2-ylmethyl)-7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(oxolan-2-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-piperazin-1-ylmethanone;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1,3-thiazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide?

The InChIKey is ZWVYWXASDLUZBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H20F3N3O2.C23H18ClN5O.C21H23ClN4O.C20H20ClN3O2.C19H19ClN4O.C19H13F3N4OS.C18H19N3O2/c1-18-7-8-19-17-25(33-26(19)34(18)22-13-9-20(10-14-22)28(29,30)31)27(35)32-21-11-15-24(16-12-21)36-23-5-3-2-4-6-23;1-14-6-7-15-12-20(28-22(15)29(14)17-10-8-16(24)9-11-17)23(30)25-13-21-26-18-4-2-3-5-19(18)27-21;1-15-4-5-16-14-19(21(27)23-10-13-25-11-2-3-12-25)24-20(16)26(15)18-8-6-17(22)7-9-18;1-13-4-5-14-11-18(20(25)22-12-17-3-2-10-26-17)23-19(14)24(13)16-8-6-15(21)7-9-16;1-13-2-3-14-12-17(19(25)23-10-8-21-9-11-23)22-18(14)24(13)16-6-4-15(20)5-7-16;1-11-2-3-12-10-15(17(27)25-18-23-8-9-28-18)24-16(12)26(11)14-6-4-13(5-7-14)19(20,21)22;1-11(2)23-15-8-6-14(7-9-15)21-12(3)4-5-13-10-16(17(19)22)20-18(13)21/h2-17,33H,1H2,(H,32,35);2-12,28H,1,13H2,(H,25,30)(H,26,27);4-9,14,24H,1-3,10-13H2,(H,23,27);4-9,11,17,23H,1-3,10,12H2,(H,22,25);2-7,12,21-22H,1,8-11H2;2-10,24H,1H2,(H,23,25,27);4-11,20H,3H2,1-2H3,(H2,19,22).

What are the key properties of N-(1H-benzimidazol-2-ylmethyl)-7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(oxolan-2-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-piperazin-1-ylmethanone;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1,3-thiazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide?

N-(1H-benzimidazol-2-ylmethyl)-7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(oxolan-2-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-piperazin-1-ylmethanone;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1,3-thiazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide has a molecular weight of 2722.72 g/mol, XLogP of 33.73, 27 rotatable bonds, 15 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for N-(1H-benzimidazol-2-ylmethyl)-7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(oxolan-2-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-6-methylidene-N-(2-pyrrolidin-1-ylethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-piperazin-1-ylmethanone;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1,3-thiazol-2-yl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 162242276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).