5-(2-acetamido-5-methyl-4-pyridinyl)-N-benzyl-2-(2-chlorophenyl)furan-3-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-5-(2-chlorophenyl)-N-methyl-1,3-oxazole-4-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxylic acid;2-(2-chlorophenyl)-N-methyl-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;1-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)-5-(1H-imidazol-2-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]propan-2-one

C107H100Cl4N18O17S — CID 158727194

About 5-(2-acetamido-5-methyl-4-pyridinyl)-N-benzyl-2-(2-chlorophenyl)furan-3-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-5-(2-chlorophenyl)-N-methyl-1,3-oxazole-4-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxylic acid;2-(2-chlorophenyl)-N-methyl-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;1-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)-5-(1H-imidazol-2-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]propan-2-one

5-(2-acetamido-5-methyl-4-pyridinyl)-N-benzyl-2-(2-chlorophenyl)furan-3-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-5-(2-chlorophenyl)-N-methyl-1,3-oxazole-4-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxylic acid;2-(2-chlorophenyl)-N-methyl-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;1-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)-5-(1H-imidazol-2-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]propan-2-one (PubChem CID 158727194) has the molecular formula C107H100Cl4N18O17S and a molecular weight of 2083.96 g/mol. Its IUPAC name is 5-(2-acetamido-5-methyl-4-pyridinyl)-N-benzyl-2-(2-chlorophenyl)furan-3-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-5-(2-chlorophenyl)-N-methyl-1,3-oxazole-4-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxylic acid;2-(2-chlorophenyl)-N-methyl-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;1-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)-5-(1H-imidazol-2-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]propan-2-one.

Molecular Properties

• Compound Name: 5-(2-acetamido-5-methyl-4-pyridinyl)-N-benzyl-2-(2-chlorophenyl)furan-3-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-5-(2-chlorophenyl)-N-methyl-1,3-oxazole-4-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxylic acid;2-(2-chlorophenyl)-N-methyl-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;1-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)-5-(1H-imidazol-2-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]propan-2-one
• PubChem CID: 158727194
• Molecular Formula: C107H100Cl4N18O17S
• Molecular Weight: 2083.96 g/mol
• Exact Mass: 2080.60
• IUPAC Name: 5-(2-acetamido-5-methyl-4-pyridinyl)-N-benzyl-2-(2-chlorophenyl)furan-3-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-5-(2-chlorophenyl)-N-methyl-1,3-oxazole-4-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxylic acid;2-(2-chlorophenyl)-N-methyl-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;1-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)-5-(1H-imidazol-2-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]propan-2-one
• SMILES: CC(=O)Cc1cc(-c2nc(N3CCCS3(=O)=O)c(-c3ncc[nH]3)o2)c(C)cn1.CC(=O)Nc1cc(-c2cc(C(=O)NCc3ccccc3)c(-c3ccccc3Cl)o2)c(C)cn1.CC(=O)Nc1cc(-c2nc(-c3cc(CN4CCCC4)ccc3Cl)c(C(=O)O)o2)c(C)cn1.CNC(=O)c1cc(-c2cc(CC(C)=O)ncc2C)oc1-c1ccccc1Cl.CNC(=O)c1nc(-c2cc(NC(C)=O)ncc2C)oc1-c1ccccc1Cl
• InChI: InChI=1S/C26H22ClN3O3.C23H23ClN4O4.C21H19ClN2O3.C19H17ClN4O3.C18H19N5O4S/c1-16-14-28-24(30-17(2)31)13-20(16)23-12-21(25(33-23)19-10-6-7-11-22(19)27)26(32)29-15-18-8-4-3-5-9-18;1-13-11-25-19(26-14(2)29)10-16(13)22-27-20(21(32-22)23(30)31)17-9-15(5-6-18(17)24)12-28-7-3-4-8-28;1-12-11-24-14(8-13(2)25)9-16(12)19-10-17(21(26)23-3)20(27-19)15-6-4-5-7-18(15)22;1-10-9-22-15(23-11(2)25)8-13(10)19-24-16(18(26)21-3)17(27-19)12-6-4-5-7-14(12)20;1-11-10-21-13(8-12(2)24)9-14(11)18-22-17(23-6-3-7-28(23,25)26)15(27-18)16-19-4-5-20-16/h3-14H,15H2,1-2H3,(H,29,32)(H,28,30,31);5-6,9-11H,3-4,7-8,12H2,1-2H3,(H,30,31)(H,25,26,29);4-7,9-11H,8H2,1-3H3,(H,23,26);4-9H,1-3H3,(H,21,26)(H,22,23,25);4-5,9-10H,3,6-8H2,1-2H3,(H,19,20)
• InChIKey: IKQQIJWLVMCMAK-UHFFFAOYSA-N
• XLogP: 20.73
• TPSA: 484.16 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 26
• Rotatable Bonds: 26
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2083.96
LogP ≤ 5	20.73
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of 5-(2-acetamido-5-methyl-4-pyridinyl)-N-benzyl-2-(2-chlorophenyl)furan-3-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-5-(2-chlorophenyl)-N-methyl-1,3-oxazole-4-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxylic acid;2-(2-chlorophenyl)-N-methyl-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;1-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)-5-(1H-imidazol-2-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]propan-2-one?

The IUPAC name of 5-(2-acetamido-5-methyl-4-pyridinyl)-N-benzyl-2-(2-chlorophenyl)furan-3-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-5-(2-chlorophenyl)-N-methyl-1,3-oxazole-4-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxylic acid;2-(2-chlorophenyl)-N-methyl-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;1-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)-5-(1H-imidazol-2-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]propan-2-one (CID 158727194) is 5-(2-acetamido-5-methyl-4-pyridinyl)-N-benzyl-2-(2-chlorophenyl)furan-3-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-5-(2-chlorophenyl)-N-methyl-1,3-oxazole-4-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxylic acid;2-(2-chlorophenyl)-N-methyl-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;1-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)-5-(1H-imidazol-2-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]propan-2-one.

What is the SMILES notation for 5-(2-acetamido-5-methyl-4-pyridinyl)-N-benzyl-2-(2-chlorophenyl)furan-3-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-5-(2-chlorophenyl)-N-methyl-1,3-oxazole-4-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxylic acid;2-(2-chlorophenyl)-N-methyl-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;1-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)-5-(1H-imidazol-2-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]propan-2-one?

The canonical SMILES for 5-(2-acetamido-5-methyl-4-pyridinyl)-N-benzyl-2-(2-chlorophenyl)furan-3-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-5-(2-chlorophenyl)-N-methyl-1,3-oxazole-4-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxylic acid;2-(2-chlorophenyl)-N-methyl-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;1-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)-5-(1H-imidazol-2-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]propan-2-one is CC(=O)Cc1cc(-c2nc(N3CCCS3(=O)=O)c(-c3ncc[nH]3)o2)c(C)cn1.CC(=O)Nc1cc(-c2cc(C(=O)NCc3ccccc3)c(-c3ccccc3Cl)o2)c(C)cn1.CC(=O)Nc1cc(-c2nc(-c3cc(CN4CCCC4)ccc3Cl)c(C(=O)O)o2)c(C)cn1.CNC(=O)c1cc(-c2cc(CC(C)=O)ncc2C)oc1-c1ccccc1Cl.CNC(=O)c1nc(-c2cc(NC(C)=O)ncc2C)oc1-c1ccccc1Cl.

What is the InChIKey of 5-(2-acetamido-5-methyl-4-pyridinyl)-N-benzyl-2-(2-chlorophenyl)furan-3-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-5-(2-chlorophenyl)-N-methyl-1,3-oxazole-4-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxylic acid;2-(2-chlorophenyl)-N-methyl-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;1-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)-5-(1H-imidazol-2-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]propan-2-one?

The InChIKey is IKQQIJWLVMCMAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22ClN3O3.C23H23ClN4O4.C21H19ClN2O3.C19H17ClN4O3.C18H19N5O4S/c1-16-14-28-24(30-17(2)31)13-20(16)23-12-21(25(33-23)19-10-6-7-11-22(19)27)26(32)29-15-18-8-4-3-5-9-18;1-13-11-25-19(26-14(2)29)10-16(13)22-27-20(21(32-22)23(30)31)17-9-15(5-6-18(17)24)12-28-7-3-4-8-28;1-12-11-24-14(8-13(2)25)9-16(12)19-10-17(21(26)23-3)20(27-19)15-6-4-5-7-18(15)22;1-10-9-22-15(23-11(2)25)8-13(10)19-24-16(18(26)21-3)17(27-19)12-6-4-5-7-14(12)20;1-11-10-21-13(8-12(2)24)9-14(11)18-22-17(23-6-3-7-28(23,25)26)15(27-18)16-19-4-5-20-16/h3-14H,15H2,1-2H3,(H,29,32)(H,28,30,31);5-6,9-11H,3-4,7-8,12H2,1-2H3,(H,30,31)(H,25,26,29);4-7,9-11H,8H2,1-3H3,(H,23,26);4-9H,1-3H3,(H,21,26)(H,22,23,25);4-5,9-10H,3,6-8H2,1-2H3,(H,19,20).

What are the key properties of 5-(2-acetamido-5-methyl-4-pyridinyl)-N-benzyl-2-(2-chlorophenyl)furan-3-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-5-(2-chlorophenyl)-N-methyl-1,3-oxazole-4-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxylic acid;2-(2-chlorophenyl)-N-methyl-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;1-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)-5-(1H-imidazol-2-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]propan-2-one?

5-(2-acetamido-5-methyl-4-pyridinyl)-N-benzyl-2-(2-chlorophenyl)furan-3-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-5-(2-chlorophenyl)-N-methyl-1,3-oxazole-4-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxylic acid;2-(2-chlorophenyl)-N-methyl-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;1-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)-5-(1H-imidazol-2-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]propan-2-one has a molecular weight of 2083.96 g/mol, XLogP of 20.73, 26 rotatable bonds, 8 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(2-acetamido-5-methyl-4-pyridinyl)-N-benzyl-2-(2-chlorophenyl)furan-3-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-5-(2-chlorophenyl)-N-methyl-1,3-oxazole-4-carboxamide;2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxylic acid;2-(2-chlorophenyl)-N-methyl-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;1-[4-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)-5-(1H-imidazol-2-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]propan-2-one is sourced from PubChem (CID 158727194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).