7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid;7-(4-fluorophenyl)-6-methylidene-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-fluorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;N-[(3-methoxyphenyl)methyl]-6-methylidene-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone;1-methyl-6-methylidene-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine-2-carboxylic acid

C150H120ClF14N19O16 — CID 159346385

About 7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid;7-(4-fluorophenyl)-6-methylidene-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-fluorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;N-[(3-methoxyphenyl)methyl]-6-methylidene-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone;1-methyl-6-methylidene-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine-2-carboxylic acid

7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid;7-(4-fluorophenyl)-6-methylidene-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-fluorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;N-[(3-methoxyphenyl)methyl]-6-methylidene-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone;1-methyl-6-methylidene-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine-2-carboxylic acid (PubChem CID 159346385) has the molecular formula C150H120ClF14N19O16 and a molecular weight of 2746.15 g/mol. Its IUPAC name is 7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid;7-(4-fluorophenyl)-6-methylidene-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-fluorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;N-[(3-methoxyphenyl)methyl]-6-methylidene-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone;1-methyl-6-methylidene-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine-2-carboxylic acid.

Molecular Properties

• Compound Name: 7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid;7-(4-fluorophenyl)-6-methylidene-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-fluorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;N-[(3-methoxyphenyl)methyl]-6-methylidene-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone;1-methyl-6-methylidene-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine-2-carboxylic acid
• PubChem CID: 159346385
• Molecular Formula: C150H120ClF14N19O16
• Molecular Weight: 2746.15 g/mol
• Exact Mass: 2743.86
• IUPAC Name: 7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid;7-(4-fluorophenyl)-6-methylidene-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-fluorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;N-[(3-methoxyphenyl)methyl]-6-methylidene-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone;1-methyl-6-methylidene-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine-2-carboxylic acid
• SMILES: C=C1C=Cc2cc(C(=O)N3CCCC3)[nH]c2N1c1ccc(C(F)(F)F)cc1.C=C1C=Cc2cc(C(=O)N3CCOCC3)[nH]c2N1c1ccc(F)cc1.C=C1C=Cc2cc(C(=O)NCc3cccc(OC)c3)[nH]c2N1c1ccc(OC(F)(F)F)cc1.C=C1C=Cc2cc(C(=O)Nc3ccc(Oc4ccccc4)cc3)[nH]c2N1c1ccc(F)cc1.C=C1C=Cc2cc(C(=O)Nc3ccc(Oc4ccccc4)cc3)[nH]c2N1c1ccc(OC(F)(F)F)cc1.C=C1C=Cc2cc(C(=O)O)[nH]c2N1c1ccc(Cl)cc1.C=C1C=Cc2cc(C(=O)O)n(C)c2N1c1ccc(OC(F)(F)F)cc1
• InChI: InChI=1S/C28H20F3N3O3.C27H20FN3O2.C24H20F3N3O3.C20H18F3N3O.C19H18FN3O2.C17H13F3N2O3.C15H11ClN2O2/c1-18-7-8-19-17-25(33-26(19)34(18)21-11-15-24(16-12-21)37-28(29,30)31)27(35)32-20-9-13-23(14-10-20)36-22-5-3-2-4-6-22;1-18-7-8-19-17-25(30-26(19)31(18)22-13-9-20(28)10-14-22)27(32)29-21-11-15-24(16-12-21)33-23-5-3-2-4-6-23;1-15-6-7-17-13-21(23(31)28-14-16-4-3-5-20(12-16)32-2)29-22(17)30(15)18-8-10-19(11-9-18)33-24(25,26)27;1-13-4-5-14-12-17(19(27)25-10-2-3-11-25)24-18(14)26(13)16-8-6-15(7-9-16)20(21,22)23;1-13-2-3-14-12-17(19(24)22-8-10-25-11-9-22)21-18(14)23(13)16-6-4-15(20)5-7-16;1-10-3-4-11-9-14(16(23)24)21(2)15(11)22(10)12-5-7-13(8-6-12)25-17(18,19)20;1-9-2-3-10-8-13(15(19)20)17-14(10)18(9)12-6-4-11(16)5-7-12/h2-17,33H,1H2,(H,32,35);2-17,30H,1H2,(H,29,32);3-13,29H,1,14H2,2H3,(H,28,31);4-9,12,24H,1-3,10-11H2;2-7,12,21H,1,8-11H2;3-9H,1H2,2H3,(H,23,24);2-8,17H,1H2,(H,19,20)
• InChIKey: LGTXKNANBVGOTJ-UHFFFAOYSA-N
• XLogP: 36.64
• TPSA: 389.48 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 22
• Rotatable Bonds: 26
• Heavy Atoms: 200
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2746.15
LogP ≤ 5	36.64
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid;7-(4-fluorophenyl)-6-methylidene-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-fluorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;N-[(3-methoxyphenyl)methyl]-6-methylidene-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone;1-methyl-6-methylidene-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine-2-carboxylic acid?

The IUPAC name of 7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid;7-(4-fluorophenyl)-6-methylidene-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-fluorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;N-[(3-methoxyphenyl)methyl]-6-methylidene-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone;1-methyl-6-methylidene-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine-2-carboxylic acid (CID 159346385) is 7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid;7-(4-fluorophenyl)-6-methylidene-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-fluorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;N-[(3-methoxyphenyl)methyl]-6-methylidene-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone;1-methyl-6-methylidene-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine-2-carboxylic acid.

What is the SMILES notation for 7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid;7-(4-fluorophenyl)-6-methylidene-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-fluorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;N-[(3-methoxyphenyl)methyl]-6-methylidene-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone;1-methyl-6-methylidene-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine-2-carboxylic acid?

The canonical SMILES for 7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid;7-(4-fluorophenyl)-6-methylidene-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-fluorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;N-[(3-methoxyphenyl)methyl]-6-methylidene-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone;1-methyl-6-methylidene-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine-2-carboxylic acid is C=C1C=Cc2cc(C(=O)N3CCCC3)[nH]c2N1c1ccc(C(F)(F)F)cc1.C=C1C=Cc2cc(C(=O)N3CCOCC3)[nH]c2N1c1ccc(F)cc1.C=C1C=Cc2cc(C(=O)NCc3cccc(OC)c3)[nH]c2N1c1ccc(OC(F)(F)F)cc1.C=C1C=Cc2cc(C(=O)Nc3ccc(Oc4ccccc4)cc3)[nH]c2N1c1ccc(F)cc1.C=C1C=Cc2cc(C(=O)Nc3ccc(Oc4ccccc4)cc3)[nH]c2N1c1ccc(OC(F)(F)F)cc1.C=C1C=Cc2cc(C(=O)O)[nH]c2N1c1ccc(Cl)cc1.C=C1C=Cc2cc(C(=O)O)n(C)c2N1c1ccc(OC(F)(F)F)cc1.

What is the InChIKey of 7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid;7-(4-fluorophenyl)-6-methylidene-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-fluorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;N-[(3-methoxyphenyl)methyl]-6-methylidene-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone;1-methyl-6-methylidene-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine-2-carboxylic acid?

The InChIKey is LGTXKNANBVGOTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H20F3N3O3.C27H20FN3O2.C24H20F3N3O3.C20H18F3N3O.C19H18FN3O2.C17H13F3N2O3.C15H11ClN2O2/c1-18-7-8-19-17-25(33-26(19)34(18)21-11-15-24(16-12-21)37-28(29,30)31)27(35)32-20-9-13-23(14-10-20)36-22-5-3-2-4-6-22;1-18-7-8-19-17-25(30-26(19)31(18)22-13-9-20(28)10-14-22)27(32)29-21-11-15-24(16-12-21)33-23-5-3-2-4-6-23;1-15-6-7-17-13-21(23(31)28-14-16-4-3-5-20(12-16)32-2)29-22(17)30(15)18-8-10-19(11-9-18)33-24(25,26)27;1-13-4-5-14-12-17(19(27)25-10-2-3-11-25)24-18(14)26(13)16-8-6-15(7-9-16)20(21,22)23;1-13-2-3-14-12-17(19(24)22-8-10-25-11-9-22)21-18(14)23(13)16-6-4-15(20)5-7-16;1-10-3-4-11-9-14(16(23)24)21(2)15(11)22(10)12-5-7-13(8-6-12)25-17(18,19)20;1-9-2-3-10-8-13(15(19)20)17-14(10)18(9)12-6-4-11(16)5-7-12/h2-17,33H,1H2,(H,32,35);2-17,30H,1H2,(H,29,32);3-13,29H,1,14H2,2H3,(H,28,31);4-9,12,24H,1-3,10-11H2;2-7,12,21H,1,8-11H2;3-9H,1H2,2H3,(H,23,24);2-8,17H,1H2,(H,19,20).

What are the key properties of 7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid;7-(4-fluorophenyl)-6-methylidene-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-fluorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;N-[(3-methoxyphenyl)methyl]-6-methylidene-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone;1-methyl-6-methylidene-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine-2-carboxylic acid?

7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid;7-(4-fluorophenyl)-6-methylidene-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-fluorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;N-[(3-methoxyphenyl)methyl]-6-methylidene-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone;1-methyl-6-methylidene-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine-2-carboxylic acid has a molecular weight of 2746.15 g/mol, XLogP of 36.64, 26 rotatable bonds, 11 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid;7-(4-fluorophenyl)-6-methylidene-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-fluorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;N-[(3-methoxyphenyl)methyl]-6-methylidene-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(4-phenoxyphenyl)-7-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]-pyrrolidin-1-ylmethanone;1-methyl-6-methylidene-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-b]pyridine-2-carboxylic acid is sourced from PubChem (CID 159346385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).