N-(cyclopropylcarbamoyl)-3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzamide;ethyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-N-(methoxycarbamoyl)benzamide;methyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;propan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate

C90H70F5N17O19 — CID 158263468

About N-(cyclopropylcarbamoyl)-3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzamide;ethyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-N-(methoxycarbamoyl)benzamide;methyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;propan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate

N-(cyclopropylcarbamoyl)-3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzamide;ethyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-N-(methoxycarbamoyl)benzamide;methyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;propan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate (PubChem CID 158263468) has the molecular formula C90H70F5N17O19 and a molecular weight of 1788.64 g/mol. Its IUPAC name is N-(cyclopropylcarbamoyl)-3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzamide;ethyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-N-(methoxycarbamoyl)benzamide;methyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;propan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate.

Molecular Properties

• Compound Name: N-(cyclopropylcarbamoyl)-3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzamide;ethyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-N-(methoxycarbamoyl)benzamide;methyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;propan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate
• PubChem CID: 158263468
• Molecular Formula: C90H70F5N17O19
• Molecular Weight: 1788.64 g/mol
• Exact Mass: 1787.50
• IUPAC Name: N-(cyclopropylcarbamoyl)-3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzamide;ethyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-N-(methoxycarbamoyl)benzamide;methyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;propan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate
• SMILES: CC(C)OC(=O)NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1.CCOC(=O)NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1.COC(=O)NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1.CONC(=O)NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1.O=C(NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1)NC1CC1
• InChI: InChI=1S/C19H15FN4O3.C19H16FN3O4.C18H14FN3O4.C17H13FN4O4.C17H12FN3O4/c20-15-7-2-1-6-14(15)18-22-16(24-27-18)11-4-3-5-12(10-11)17(25)23-19(26)21-13-8-9-13;1-11(2)26-19(25)22-17(24)13-7-5-6-12(10-13)16-21-18(27-23-16)14-8-3-4-9-15(14)20;1-2-25-18(24)21-16(23)12-7-5-6-11(10-12)15-20-17(26-22-15)13-8-3-4-9-14(13)19;1-25-22-17(24)20-15(23)11-6-4-5-10(9-11)14-19-16(26-21-14)12-7-2-3-8-13(12)18;1-24-17(23)20-15(22)11-6-4-5-10(9-11)14-19-16(25-21-14)12-7-2-3-8-13(12)18/h1-7,10,13H,8-9H2,(H2,21,23,25,26);3-11H,1-2H3,(H,22,24,25);3-10H,2H2,1H3,(H,21,23,24);2-9H,1H3,(H2,20,22,23,24);2-9H,1H3,(H,20,22,23)
• InChIKey: GIDROJOHVSSTIK-UHFFFAOYSA-N
• XLogP: 15.97
• TPSA: 486.43 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 29
• Rotatable Bonds: 19
• Heavy Atoms: 131
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1788.64
LogP ≤ 5	15.97
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylcarbamoyl)-3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzamide;ethyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-N-(methoxycarbamoyl)benzamide;methyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;propan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate?

The IUPAC name of N-(cyclopropylcarbamoyl)-3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzamide;ethyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-N-(methoxycarbamoyl)benzamide;methyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;propan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate (CID 158263468) is N-(cyclopropylcarbamoyl)-3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzamide;ethyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-N-(methoxycarbamoyl)benzamide;methyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;propan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate.

What is the SMILES notation for N-(cyclopropylcarbamoyl)-3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzamide;ethyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-N-(methoxycarbamoyl)benzamide;methyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;propan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate?

The canonical SMILES for N-(cyclopropylcarbamoyl)-3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzamide;ethyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-N-(methoxycarbamoyl)benzamide;methyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;propan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate is CC(C)OC(=O)NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1.CCOC(=O)NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1.COC(=O)NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1.CONC(=O)NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1.O=C(NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1)NC1CC1.

What is the InChIKey of N-(cyclopropylcarbamoyl)-3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzamide;ethyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-N-(methoxycarbamoyl)benzamide;methyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;propan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate?

The InChIKey is GIDROJOHVSSTIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4O3.C19H16FN3O4.C18H14FN3O4.C17H13FN4O4.C17H12FN3O4/c20-15-7-2-1-6-14(15)18-22-16(24-27-18)11-4-3-5-12(10-11)17(25)23-19(26)21-13-8-9-13;1-11(2)26-19(25)22-17(24)13-7-5-6-12(10-13)16-21-18(27-23-16)14-8-3-4-9-15(14)20;1-2-25-18(24)21-16(23)12-7-5-6-11(10-12)15-20-17(26-22-15)13-8-3-4-9-14(13)19;1-25-22-17(24)20-15(23)11-6-4-5-10(9-11)14-19-16(26-21-14)12-7-2-3-8-13(12)18;1-24-17(23)20-15(22)11-6-4-5-10(9-11)14-19-16(25-21-14)12-7-2-3-8-13(12)18/h1-7,10,13H,8-9H2,(H2,21,23,25,26);3-11H,1-2H3,(H,22,24,25);3-10H,2H2,1H3,(H,21,23,24);2-9H,1H3,(H2,20,22,23,24);2-9H,1H3,(H,20,22,23).

What are the key properties of N-(cyclopropylcarbamoyl)-3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzamide;ethyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-N-(methoxycarbamoyl)benzamide;methyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;propan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate?

N-(cyclopropylcarbamoyl)-3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzamide;ethyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-N-(methoxycarbamoyl)benzamide;methyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;propan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate has a molecular weight of 1788.64 g/mol, XLogP of 15.97, 19 rotatable bonds, 7 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for N-(cyclopropylcarbamoyl)-3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzamide;ethyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]-N-(methoxycarbamoyl)benzamide;methyl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;propan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate is sourced from PubChem (CID 158263468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).