2-[2-(ethylcarbamoylamino)-5-[5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3-pyridinyl]-4-pyridinyl]-N-(2-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxamide

C23H24N8O5S — CID 68639596

About 2-[2-(ethylcarbamoylamino)-5-[5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3-pyridinyl]-4-pyridinyl]-N-(2-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxamide

2-[2-(ethylcarbamoylamino)-5-[5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3-pyridinyl]-4-pyridinyl]-N-(2-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxamide (PubChem CID 68639596) has the molecular formula C23H24N8O5S and a molecular weight of 524.56 g/mol. Its IUPAC name is 2-[2-(ethylcarbamoylamino)-5-[5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3-pyridinyl]-4-pyridinyl]-N-(2-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

• Compound Name: 2-[2-(ethylcarbamoylamino)-5-[5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3-pyridinyl]-4-pyridinyl]-N-(2-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxamide
• PubChem CID: 68639596
• Molecular Formula: C23H24N8O5S
• Molecular Weight: 524.56 g/mol
• Exact Mass: 524.16
• IUPAC Name: 2-[2-(ethylcarbamoylamino)-5-[5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3-pyridinyl]-4-pyridinyl]-N-(2-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxamide
• SMILES: CCNC(=O)Nc1cc(-c2nc(C)c(C(=O)NCCOC)s2)c(-c2cncc(-c3n[nH]c(=O)o3)c2)cn1
• InChI: InChI=1S/C23H24N8O5S/c1-4-25-22(33)29-17-8-15(21-28-12(2)18(37-21)19(32)26-5-6-35-3)16(11-27-17)13-7-14(10-24-9-13)20-30-31-23(34)36-20/h7-11H,4-6H2,1-3H3,(H,26,32)(H,31,34)(H2,25,27,29,33)
• InChIKey: ZIBPXPFUFIOREC-UHFFFAOYSA-N
• XLogP: 2.44
• TPSA: 177.02 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 10
• Rotatable Bonds: 9
• Heavy Atoms: 37
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	524.56
LogP ≤ 5	2.44
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[2-(ethylcarbamoylamino)-5-[5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3-pyridinyl]-4-pyridinyl]-N-(2-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxamide?

The IUPAC name of 2-[2-(ethylcarbamoylamino)-5-[5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3-pyridinyl]-4-pyridinyl]-N-(2-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxamide (CID 68639596) is 2-[2-(ethylcarbamoylamino)-5-[5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3-pyridinyl]-4-pyridinyl]-N-(2-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxamide.

What is the SMILES notation for 2-[2-(ethylcarbamoylamino)-5-[5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3-pyridinyl]-4-pyridinyl]-N-(2-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxamide?

The canonical SMILES for 2-[2-(ethylcarbamoylamino)-5-[5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3-pyridinyl]-4-pyridinyl]-N-(2-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxamide is CCNC(=O)Nc1cc(-c2nc(C)c(C(=O)NCCOC)s2)c(-c2cncc(-c3n[nH]c(=O)o3)c2)cn1.

What is the InChIKey of 2-[2-(ethylcarbamoylamino)-5-[5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3-pyridinyl]-4-pyridinyl]-N-(2-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxamide?

The InChIKey is ZIBPXPFUFIOREC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N8O5S/c1-4-25-22(33)29-17-8-15(21-28-12(2)18(37-21)19(32)26-5-6-35-3)16(11-27-17)13-7-14(10-24-9-13)20-30-31-23(34)36-20/h7-11H,4-6H2,1-3H3,(H,26,32)(H,31,34)(H2,25,27,29,33).

What are the key properties of 2-[2-(ethylcarbamoylamino)-5-[5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3-pyridinyl]-4-pyridinyl]-N-(2-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxamide?

2-[2-(ethylcarbamoylamino)-5-[5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3-pyridinyl]-4-pyridinyl]-N-(2-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxamide has a molecular weight of 524.56 g/mol, XLogP of 2.44, 9 rotatable bonds, 4 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-(ethylcarbamoylamino)-5-[5-(2-oxo-3H-1,3,4-oxadiazol-5-yl)-3-pyridinyl]-4-pyridinyl]-N-(2-methoxyethyl)-4-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 68639596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).