N-benzyl-6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;6-methylidene-N-(oxolan-2-ylmethyl)-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1-phenylethyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide

C111H101Cl2F6N15O9 — CID 158132063

About N-benzyl-6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;6-methylidene-N-(oxolan-2-ylmethyl)-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1-phenylethyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide

N-benzyl-6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;6-methylidene-N-(oxolan-2-ylmethyl)-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1-phenylethyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide (PubChem CID 158132063) has the molecular formula C111H101Cl2F6N15O9 and a molecular weight of 1974.02 g/mol. Its IUPAC name is N-benzyl-6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;6-methylidene-N-(oxolan-2-ylmethyl)-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1-phenylethyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: N-benzyl-6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;6-methylidene-N-(oxolan-2-ylmethyl)-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1-phenylethyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
• PubChem CID: 158132063
• Molecular Formula: C111H101Cl2F6N15O9
• Molecular Weight: 1974.02 g/mol
• Exact Mass: 1971.72
• IUPAC Name: N-benzyl-6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;6-methylidene-N-(oxolan-2-ylmethyl)-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1-phenylethyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
• SMILES: C=C1C=Cc2cc(C(=O)N3CCOCC3)[nH]c2N1c1ccc(Cl)cc1.C=C1C=Cc2cc(C(=O)NC(C)c3ccccc3)[nH]c2N1c1ccc(C(F)(F)F)cc1.C=C1C=Cc2cc(C(=O)NCC3CCCO3)[nH]c2N1c1ccc(OC(C)C)cc1.C=C1C=Cc2cc(C(=O)NCc3ccccc3)[nH]c2N1c1ccc(C(F)(F)F)cc1.C=C1C=Cc2cc(C(=O)Nc3cccc(OC)c3)[nH]c2N1c1ccc(Cl)cc1
• InChI: InChI=1S/C24H20F3N3O.C23H18F3N3O.C23H27N3O3.C22H18ClN3O2.C19H18ClN3O2/c1-15-8-9-18-14-21(23(31)28-16(2)17-6-4-3-5-7-17)29-22(18)30(15)20-12-10-19(11-13-20)24(25,26)27;1-15-7-8-17-13-20(22(30)27-14-16-5-3-2-4-6-16)28-21(17)29(15)19-11-9-18(10-12-19)23(24,25)26;1-15(2)29-19-10-8-18(9-11-19)26-16(3)6-7-17-13-21(25-22(17)26)23(27)24-14-20-5-4-12-28-20;1-14-6-7-15-12-20(22(27)24-17-4-3-5-19(13-17)28-2)25-21(15)26(14)18-10-8-16(23)9-11-18;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/h3-14,16,29H,1H2,2H3,(H,28,31);2-13,28H,1,14H2,(H,27,30);6-11,13,15,20,25H,3-5,12,14H2,1-2H3,(H,24,27);3-13,25H,1H2,2H3,(H,24,27);2-7,12,21H,1,8-11H2
• InChIKey: FSWZIPBTRPTYBC-UHFFFAOYSA-N
• XLogP: 25.66
• TPSA: 268.78 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 14
• Rotatable Bonds: 20
• Heavy Atoms: 143
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1974.02
LogP ≤ 5	25.66
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of N-benzyl-6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;6-methylidene-N-(oxolan-2-ylmethyl)-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1-phenylethyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide?

The IUPAC name of N-benzyl-6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;6-methylidene-N-(oxolan-2-ylmethyl)-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1-phenylethyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide (CID 158132063) is N-benzyl-6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;6-methylidene-N-(oxolan-2-ylmethyl)-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1-phenylethyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide.

What is the SMILES notation for N-benzyl-6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;6-methylidene-N-(oxolan-2-ylmethyl)-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1-phenylethyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide?

The canonical SMILES for N-benzyl-6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;6-methylidene-N-(oxolan-2-ylmethyl)-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1-phenylethyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide is C=C1C=Cc2cc(C(=O)N3CCOCC3)[nH]c2N1c1ccc(Cl)cc1.C=C1C=Cc2cc(C(=O)NC(C)c3ccccc3)[nH]c2N1c1ccc(C(F)(F)F)cc1.C=C1C=Cc2cc(C(=O)NCC3CCCO3)[nH]c2N1c1ccc(OC(C)C)cc1.C=C1C=Cc2cc(C(=O)NCc3ccccc3)[nH]c2N1c1ccc(C(F)(F)F)cc1.C=C1C=Cc2cc(C(=O)Nc3cccc(OC)c3)[nH]c2N1c1ccc(Cl)cc1.

What is the InChIKey of N-benzyl-6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;6-methylidene-N-(oxolan-2-ylmethyl)-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1-phenylethyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide?

The InChIKey is FSWZIPBTRPTYBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20F3N3O.C23H18F3N3O.C23H27N3O3.C22H18ClN3O2.C19H18ClN3O2/c1-15-8-9-18-14-21(23(31)28-16(2)17-6-4-3-5-7-17)29-22(18)30(15)20-12-10-19(11-13-20)24(25,26)27;1-15-7-8-17-13-20(22(30)27-14-16-5-3-2-4-6-16)28-21(17)29(15)19-11-9-18(10-12-19)23(24,25)26;1-15(2)29-19-10-8-18(9-11-19)26-16(3)6-7-17-13-21(25-22(17)26)23(27)24-14-20-5-4-12-28-20;1-14-6-7-15-12-20(22(27)24-17-4-3-5-19(13-17)28-2)25-21(15)26(14)18-10-8-16(23)9-11-18;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/h3-14,16,29H,1H2,2H3,(H,28,31);2-13,28H,1,14H2,(H,27,30);6-11,13,15,20,25H,3-5,12,14H2,1-2H3,(H,24,27);3-13,25H,1H2,2H3,(H,24,27);2-7,12,21H,1,8-11H2.

What are the key properties of N-benzyl-6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;6-methylidene-N-(oxolan-2-ylmethyl)-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1-phenylethyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide?

N-benzyl-6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;6-methylidene-N-(oxolan-2-ylmethyl)-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1-phenylethyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide has a molecular weight of 1974.02 g/mol, XLogP of 25.66, 20 rotatable bonds, 9 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for N-benzyl-6-methylidene-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;7-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;[7-(4-chlorophenyl)-6-methylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]-morpholin-4-ylmethanone;6-methylidene-N-(oxolan-2-ylmethyl)-7-(4-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide;6-methylidene-N-(1-phenylethyl)-7-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 158132063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).