2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxamide;1-[4-[4-acetyl-5-(2-chlorophenyl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one;2-(2-chlorophenyl)-N-(2-methoxyethyl)-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;N-[4-[5-(2-chlorophenyl)-4-(1H-pyrazol-5-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]acetamide;1-[4-[5-[3-(dimethylamino)piperidin-1-yl]-4-(1H-1,2,4-triazol-5-yl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one

C109H109Cl4N19O14 — CID 157156784

About 2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxamide;1-[4-[4-acetyl-5-(2-chlorophenyl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one;2-(2-chlorophenyl)-N-(2-methoxyethyl)-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;N-[4-[5-(2-chlorophenyl)-4-(1H-pyrazol-5-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]acetamide;1-[4-[5-[3-(dimethylamino)piperidin-1-yl]-4-(1H-1,2,4-triazol-5-yl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one

2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxamide;1-[4-[4-acetyl-5-(2-chlorophenyl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one;2-(2-chlorophenyl)-N-(2-methoxyethyl)-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;N-[4-[5-(2-chlorophenyl)-4-(1H-pyrazol-5-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]acetamide;1-[4-[5-[3-(dimethylamino)piperidin-1-yl]-4-(1H-1,2,4-triazol-5-yl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one (PubChem CID 157156784) has the molecular formula C109H109Cl4N19O14 and a molecular weight of 2051.00 g/mol. Its IUPAC name is 2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxamide;1-[4-[4-acetyl-5-(2-chlorophenyl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one;2-(2-chlorophenyl)-N-(2-methoxyethyl)-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;N-[4-[5-(2-chlorophenyl)-4-(1H-pyrazol-5-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]acetamide;1-[4-[5-[3-(dimethylamino)piperidin-1-yl]-4-(1H-1,2,4-triazol-5-yl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one.

Molecular Properties

• Compound Name: 2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxamide;1-[4-[4-acetyl-5-(2-chlorophenyl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one;2-(2-chlorophenyl)-N-(2-methoxyethyl)-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;N-[4-[5-(2-chlorophenyl)-4-(1H-pyrazol-5-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]acetamide;1-[4-[5-[3-(dimethylamino)piperidin-1-yl]-4-(1H-1,2,4-triazol-5-yl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one
• PubChem CID: 157156784
• Molecular Formula: C109H109Cl4N19O14
• Molecular Weight: 2051.00 g/mol
• Exact Mass: 2047.72
• IUPAC Name: 2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxamide;1-[4-[4-acetyl-5-(2-chlorophenyl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one;2-(2-chlorophenyl)-N-(2-methoxyethyl)-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;N-[4-[5-(2-chlorophenyl)-4-(1H-pyrazol-5-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]acetamide;1-[4-[5-[3-(dimethylamino)piperidin-1-yl]-4-(1H-1,2,4-triazol-5-yl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one
• SMILES: CC(=O)Cc1cc(-c2cc(-c3ncn[nH]3)c(N3CCCC(N(C)C)C3)o2)c(C)cn1.CC(=O)Cc1cc(-c2cc(C(C)=O)c(-c3ccccc3Cl)o2)c(C)cn1.CC(=O)Nc1cc(-c2nc(-c3cc(CN4CCCC4)ccc3Cl)c(C(N)=O)o2)c(C)cn1.CC(=O)Nc1cc(-c2nc(-c3ccn[nH]3)c(-c3ccccc3Cl)o2)c(C)cn1.COCCNC(=O)c1cc(-c2cc(CC(C)=O)ncc2C)oc1-c1ccccc1Cl
• InChI: InChI=1S/C23H24ClN5O3.C23H23ClN2O4.C22H28N6O2.C21H18ClNO3.C20H16ClN5O2/c1-13-11-26-19(27-14(2)30)10-16(13)23-28-20(21(32-23)22(25)31)17-9-15(5-6-18(17)24)12-29-7-3-4-8-29;1-14-13-26-16(10-15(2)27)11-18(14)21-12-19(23(28)25-8-9-29-3)22(30-21)17-6-4-5-7-20(17)24;1-14-11-23-16(8-15(2)29)9-18(14)20-10-19(21-24-13-25-26-21)22(30-20)28-7-5-6-17(12-28)27(3)4;1-12-11-23-15(8-13(2)24)9-17(12)20-10-18(14(3)25)21(26-20)16-6-4-5-7-19(16)22;1-11-10-22-17(24-12(2)27)9-14(11)20-25-18(16-7-8-23-26-16)19(28-20)13-5-3-4-6-15(13)21/h5-6,9-11H,3-4,7-8,12H2,1-2H3,(H2,25,31)(H,26,27,30);4-7,11-13H,8-10H2,1-3H3,(H,25,28);9-11,13,17H,5-8,12H2,1-4H3,(H,24,25,26);4-7,9-11H,8H2,1-3H3;3-10H,1-2H3,(H,23,26)(H,22,24,27)
• InChIKey: ALXBVKULFGBYLY-UHFFFAOYSA-N
• XLogP: 21.61
• TPSA: 443.80 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 27
• Rotatable Bonds: 29
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2051.00
LogP ≤ 5	21.61
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxamide;1-[4-[4-acetyl-5-(2-chlorophenyl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one;2-(2-chlorophenyl)-N-(2-methoxyethyl)-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;N-[4-[5-(2-chlorophenyl)-4-(1H-pyrazol-5-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]acetamide;1-[4-[5-[3-(dimethylamino)piperidin-1-yl]-4-(1H-1,2,4-triazol-5-yl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one?

The IUPAC name of 2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxamide;1-[4-[4-acetyl-5-(2-chlorophenyl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one;2-(2-chlorophenyl)-N-(2-methoxyethyl)-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;N-[4-[5-(2-chlorophenyl)-4-(1H-pyrazol-5-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]acetamide;1-[4-[5-[3-(dimethylamino)piperidin-1-yl]-4-(1H-1,2,4-triazol-5-yl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one (CID 157156784) is 2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxamide;1-[4-[4-acetyl-5-(2-chlorophenyl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one;2-(2-chlorophenyl)-N-(2-methoxyethyl)-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;N-[4-[5-(2-chlorophenyl)-4-(1H-pyrazol-5-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]acetamide;1-[4-[5-[3-(dimethylamino)piperidin-1-yl]-4-(1H-1,2,4-triazol-5-yl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one.

What is the SMILES notation for 2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxamide;1-[4-[4-acetyl-5-(2-chlorophenyl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one;2-(2-chlorophenyl)-N-(2-methoxyethyl)-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;N-[4-[5-(2-chlorophenyl)-4-(1H-pyrazol-5-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]acetamide;1-[4-[5-[3-(dimethylamino)piperidin-1-yl]-4-(1H-1,2,4-triazol-5-yl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one?

The canonical SMILES for 2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxamide;1-[4-[4-acetyl-5-(2-chlorophenyl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one;2-(2-chlorophenyl)-N-(2-methoxyethyl)-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;N-[4-[5-(2-chlorophenyl)-4-(1H-pyrazol-5-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]acetamide;1-[4-[5-[3-(dimethylamino)piperidin-1-yl]-4-(1H-1,2,4-triazol-5-yl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one is CC(=O)Cc1cc(-c2cc(-c3ncn[nH]3)c(N3CCCC(N(C)C)C3)o2)c(C)cn1.CC(=O)Cc1cc(-c2cc(C(C)=O)c(-c3ccccc3Cl)o2)c(C)cn1.CC(=O)Nc1cc(-c2nc(-c3cc(CN4CCCC4)ccc3Cl)c(C(N)=O)o2)c(C)cn1.CC(=O)Nc1cc(-c2nc(-c3ccn[nH]3)c(-c3ccccc3Cl)o2)c(C)cn1.COCCNC(=O)c1cc(-c2cc(CC(C)=O)ncc2C)oc1-c1ccccc1Cl.

What is the InChIKey of 2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxamide;1-[4-[4-acetyl-5-(2-chlorophenyl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one;2-(2-chlorophenyl)-N-(2-methoxyethyl)-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;N-[4-[5-(2-chlorophenyl)-4-(1H-pyrazol-5-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]acetamide;1-[4-[5-[3-(dimethylamino)piperidin-1-yl]-4-(1H-1,2,4-triazol-5-yl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one?

The InChIKey is ALXBVKULFGBYLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24ClN5O3.C23H23ClN2O4.C22H28N6O2.C21H18ClNO3.C20H16ClN5O2/c1-13-11-26-19(27-14(2)30)10-16(13)23-28-20(21(32-23)22(25)31)17-9-15(5-6-18(17)24)12-29-7-3-4-8-29;1-14-13-26-16(10-15(2)27)11-18(14)21-12-19(23(28)25-8-9-29-3)22(30-21)17-6-4-5-7-20(17)24;1-14-11-23-16(8-15(2)29)9-18(14)20-10-19(21-24-13-25-26-21)22(30-20)28-7-5-6-17(12-28)27(3)4;1-12-11-23-15(8-13(2)24)9-17(12)20-10-18(14(3)25)21(26-20)16-6-4-5-7-19(16)22;1-11-10-22-17(24-12(2)27)9-14(11)20-25-18(16-7-8-23-26-16)19(28-20)13-5-3-4-6-15(13)21/h5-6,9-11H,3-4,7-8,12H2,1-2H3,(H2,25,31)(H,26,27,30);4-7,11-13H,8-10H2,1-3H3,(H,25,28);9-11,13,17H,5-8,12H2,1-4H3,(H,24,25,26);4-7,9-11H,8H2,1-3H3;3-10H,1-2H3,(H,23,26)(H,22,24,27).

What are the key properties of 2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxamide;1-[4-[4-acetyl-5-(2-chlorophenyl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one;2-(2-chlorophenyl)-N-(2-methoxyethyl)-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;N-[4-[5-(2-chlorophenyl)-4-(1H-pyrazol-5-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]acetamide;1-[4-[5-[3-(dimethylamino)piperidin-1-yl]-4-(1H-1,2,4-triazol-5-yl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one?

2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxamide;1-[4-[4-acetyl-5-(2-chlorophenyl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one;2-(2-chlorophenyl)-N-(2-methoxyethyl)-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;N-[4-[5-(2-chlorophenyl)-4-(1H-pyrazol-5-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]acetamide;1-[4-[5-[3-(dimethylamino)piperidin-1-yl]-4-(1H-1,2,4-triazol-5-yl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one has a molecular weight of 2051.00 g/mol, XLogP of 21.61, 29 rotatable bonds, 6 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2-acetamido-5-methyl-4-pyridinyl)-4-[2-chloro-5-(pyrrolidin-1-ylmethyl)phenyl]-1,3-oxazole-5-carboxamide;1-[4-[4-acetyl-5-(2-chlorophenyl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one;2-(2-chlorophenyl)-N-(2-methoxyethyl)-5-[5-methyl-2-(2-oxopropyl)-4-pyridinyl]furan-3-carboxamide;N-[4-[5-(2-chlorophenyl)-4-(1H-pyrazol-5-yl)-1,3-oxazol-2-yl]-5-methyl-2-pyridinyl]acetamide;1-[4-[5-[3-(dimethylamino)piperidin-1-yl]-4-(1H-1,2,4-triazol-5-yl)furan-2-yl]-5-methyl-2-pyridinyl]propan-2-one is sourced from PubChem (CID 157156784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).