2,3-dihydro-1H-inden-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3,3-dimethylbutan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;1-methoxypropan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;oxolan-3-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate

C111H89F8N15O22 — CID 160753584

About 2,3-dihydro-1H-inden-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3,3-dimethylbutan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;1-methoxypropan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;oxolan-3-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate

2,3-dihydro-1H-inden-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3,3-dimethylbutan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;1-methoxypropan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;oxolan-3-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate (PubChem CID 160753584) has the molecular formula C111H89F8N15O22 and a molecular weight of 2137.00 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3,3-dimethylbutan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;1-methoxypropan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;oxolan-3-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate.

Molecular Properties

• Compound Name: 2,3-dihydro-1H-inden-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3,3-dimethylbutan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;1-methoxypropan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;oxolan-3-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate
• PubChem CID: 160753584
• Molecular Formula: C111H89F8N15O22
• Molecular Weight: 2137.00 g/mol
• Exact Mass: 2135.62
• IUPAC Name: 2,3-dihydro-1H-inden-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3,3-dimethylbutan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;1-methoxypropan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;oxolan-3-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate
• SMILES: CC(OC(=O)NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1)C(C)(C)C.COCC(C)OC(=O)NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1.O=C(NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1)OC(c1ccccc1)C(F)(F)F.O=C(NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1)OC1CCOC1.O=C(NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1)OC1Cc2ccccc2C1
• InChI: InChI=1S/C25H18FN3O4.C24H15F4N3O4.C22H22FN3O4.C20H16FN3O5.C20H18FN3O5/c26-21-11-4-3-10-20(21)24-27-22(29-33-24)17-8-5-9-18(12-17)23(30)28-25(31)32-19-13-15-6-1-2-7-16(15)14-19;25-18-12-5-4-11-17(18)22-29-20(31-35-22)15-9-6-10-16(13-15)21(32)30-23(33)34-19(24(26,27)28)14-7-2-1-3-8-14;1-13(22(2,3)4)29-21(28)25-19(27)15-9-7-8-14(12-15)18-24-20(30-26-18)16-10-5-6-11-17(16)23;21-16-7-2-1-6-15(16)19-22-17(24-29-19)12-4-3-5-13(10-12)18(25)23-20(26)28-14-8-9-27-11-14;1-12(11-27-2)28-20(26)23-18(25)14-7-5-6-13(10-14)17-22-19(29-24-17)15-8-3-4-9-16(15)21/h1-12,19H,13-14H2,(H,28,30,31);1-13,19H,(H,30,32,33);5-13H,1-4H3,(H,25,27,28);1-7,10,14H,8-9,11H2,(H,23,25,26);3-10,12H,11H2,1-2H3,(H,23,25,26)
• InChIKey: RXDGWGSCNNIBBA-UHFFFAOYSA-N
• XLogP: 21.77
• TPSA: 490.06 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 32
• Rotatable Bonds: 23
• Heavy Atoms: 156
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2137.00
LogP ≤ 5	21.77
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3,3-dimethylbutan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;1-methoxypropan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;oxolan-3-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate?

The IUPAC name of 2,3-dihydro-1H-inden-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3,3-dimethylbutan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;1-methoxypropan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;oxolan-3-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate (CID 160753584) is 2,3-dihydro-1H-inden-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3,3-dimethylbutan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;1-methoxypropan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;oxolan-3-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate.

What is the SMILES notation for 2,3-dihydro-1H-inden-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3,3-dimethylbutan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;1-methoxypropan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;oxolan-3-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate?

The canonical SMILES for 2,3-dihydro-1H-inden-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3,3-dimethylbutan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;1-methoxypropan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;oxolan-3-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate is CC(OC(=O)NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1)C(C)(C)C.COCC(C)OC(=O)NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1.O=C(NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1)OC(c1ccccc1)C(F)(F)F.O=C(NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1)OC1CCOC1.O=C(NC(=O)c1cccc(-c2noc(-c3ccccc3F)n2)c1)OC1Cc2ccccc2C1.

What is the InChIKey of 2,3-dihydro-1H-inden-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3,3-dimethylbutan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;1-methoxypropan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;oxolan-3-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate?

The InChIKey is RXDGWGSCNNIBBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18FN3O4.C24H15F4N3O4.C22H22FN3O4.C20H16FN3O5.C20H18FN3O5/c26-21-11-4-3-10-20(21)24-27-22(29-33-24)17-8-5-9-18(12-17)23(30)28-25(31)32-19-13-15-6-1-2-7-16(15)14-19;25-18-12-5-4-11-17(18)22-29-20(31-35-22)15-9-6-10-16(13-15)21(32)30-23(33)34-19(24(26,27)28)14-7-2-1-3-8-14;1-13(22(2,3)4)29-21(28)25-19(27)15-9-7-8-14(12-15)18-24-20(30-26-18)16-10-5-6-11-17(16)23;21-16-7-2-1-6-15(16)19-22-17(24-29-19)12-4-3-5-13(10-12)18(25)23-20(26)28-14-8-9-27-11-14;1-12(11-27-2)28-20(26)23-18(25)14-7-5-6-13(10-14)17-22-19(29-24-17)15-8-3-4-9-16(15)21/h1-12,19H,13-14H2,(H,28,30,31);1-13,19H,(H,30,32,33);5-13H,1-4H3,(H,25,27,28);1-7,10,14H,8-9,11H2,(H,23,25,26);3-10,12H,11H2,1-2H3,(H,23,25,26).

What are the key properties of 2,3-dihydro-1H-inden-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3,3-dimethylbutan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;1-methoxypropan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;oxolan-3-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate?

2,3-dihydro-1H-inden-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3,3-dimethylbutan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;1-methoxypropan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;oxolan-3-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate has a molecular weight of 2137.00 g/mol, XLogP of 21.77, 23 rotatable bonds, 5 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 2,3-dihydro-1H-inden-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;3,3-dimethylbutan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;1-methoxypropan-2-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;oxolan-3-yl N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoyl]carbamate is sourced from PubChem (CID 160753584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).