[5-(3-chlorophenyl)-1,2-oxazol-4-yl]-(3-phenylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;[3-(2-chlorophenyl)pyrrolidin-1-yl]-[5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone;[5-(4-methylphenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;(3-pyridin-3-ylpyrrolidin-1-yl)-[5-[2-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone

C138H116Cl5F6N19O14 — CID 159997752

About [5-(3-chlorophenyl)-1,2-oxazol-4-yl]-(3-phenylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;[3-(2-chlorophenyl)pyrrolidin-1-yl]-[5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone;[5-(4-methylphenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;(3-pyridin-3-ylpyrrolidin-1-yl)-[5-[2-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone

[5-(3-chlorophenyl)-1,2-oxazol-4-yl]-(3-phenylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;[3-(2-chlorophenyl)pyrrolidin-1-yl]-[5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone;[5-(4-methylphenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;(3-pyridin-3-ylpyrrolidin-1-yl)-[5-[2-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone (PubChem CID 159997752) has the molecular formula C138H116Cl5F6N19O14 and a molecular weight of 2555.82 g/mol. Its IUPAC name is [5-(3-chlorophenyl)-1,2-oxazol-4-yl]-(3-phenylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;[3-(2-chlorophenyl)pyrrolidin-1-yl]-[5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone;[5-(4-methylphenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;(3-pyridin-3-ylpyrrolidin-1-yl)-[5-[2-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone.

Molecular Properties

• Compound Name: [5-(3-chlorophenyl)-1,2-oxazol-4-yl]-(3-phenylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;[3-(2-chlorophenyl)pyrrolidin-1-yl]-[5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone;[5-(4-methylphenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;(3-pyridin-3-ylpyrrolidin-1-yl)-[5-[2-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone
• PubChem CID: 159997752
• Molecular Formula: C138H116Cl5F6N19O14
• Molecular Weight: 2555.82 g/mol
• Exact Mass: 2551.73
• IUPAC Name: [5-(3-chlorophenyl)-1,2-oxazol-4-yl]-(3-phenylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;[3-(2-chlorophenyl)pyrrolidin-1-yl]-[5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone;[5-(4-methylphenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;(3-pyridin-3-ylpyrrolidin-1-yl)-[5-[2-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone
• SMILES: Cc1ccc(-c2oncc2C(=O)N2CCC(c3ccncc3)C2)cc1.O=C(c1cnoc1-c1ccc(C(F)(F)F)cc1)N1CCC(c2ccccc2Cl)C1.O=C(c1cnoc1-c1ccc(Cl)cc1)N1CCC(c2cccnc2)C1.O=C(c1cnoc1-c1ccc(Cl)cc1)N1CCC(c2ccncc2)C1.O=C(c1cnoc1-c1ccc(Cl)cc1)N1CC[C@@H](c2cccnc2)C1.O=C(c1cnoc1-c1cccc(Cl)c1)N1CCC(c2ccccc2)C1.O=C(c1cnoc1-c1ccccc1C(F)(F)F)N1CCC(c2cccnc2)C1
• InChI: InChI=1S/C21H16ClF3N2O2.C20H17ClN2O2.C20H16F3N3O2.C20H19N3O2.3C19H16ClN3O2/c22-18-4-2-1-3-16(18)14-9-10-27(12-14)20(28)17-11-26-29-19(17)13-5-7-15(8-6-13)21(23,24)25;21-17-8-4-7-15(11-17)19-18(12-22-25-19)20(24)23-10-9-16(13-23)14-5-2-1-3-6-14;21-20(22,23)17-6-2-1-5-15(17)18-16(11-25-28-18)19(27)26-9-7-14(12-26)13-4-3-8-24-10-13;1-14-2-4-16(5-3-14)19-18(12-22-25-19)20(24)23-11-8-17(13-23)15-6-9-21-10-7-15;20-16-3-1-14(2-4-16)18-17(11-22-25-18)19(24)23-10-7-15(12-23)13-5-8-21-9-6-13;2*20-16-5-3-13(4-6-16)18-17(11-22-25-18)19(24)23-9-7-15(12-23)14-2-1-8-21-10-14/h1-8,11,14H,9-10,12H2;1-8,11-12,16H,9-10,13H2;1-6,8,10-11,14H,7,9,12H2;2-7,9-10,12,17H,8,11,13H2,1H3;1-6,8-9,11,15H,7,10,12H2;2*1-6,8,10-11,15H,7,9,12H2/t;;;;;15-;/m.....1./s1
• InChIKey: OHTLBUCUKKWCDF-DOFCDOPISA-N
• XLogP: 30.39
• TPSA: 388.83 Ų
• H-Bond Acceptors: 26
• Rotatable Bonds: 21
• Heavy Atoms: 182
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2555.82
LogP ≤ 5	30.39
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of [5-(3-chlorophenyl)-1,2-oxazol-4-yl]-(3-phenylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;[3-(2-chlorophenyl)pyrrolidin-1-yl]-[5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone;[5-(4-methylphenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;(3-pyridin-3-ylpyrrolidin-1-yl)-[5-[2-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone?

The IUPAC name of [5-(3-chlorophenyl)-1,2-oxazol-4-yl]-(3-phenylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;[3-(2-chlorophenyl)pyrrolidin-1-yl]-[5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone;[5-(4-methylphenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;(3-pyridin-3-ylpyrrolidin-1-yl)-[5-[2-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone (CID 159997752) is [5-(3-chlorophenyl)-1,2-oxazol-4-yl]-(3-phenylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;[3-(2-chlorophenyl)pyrrolidin-1-yl]-[5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone;[5-(4-methylphenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;(3-pyridin-3-ylpyrrolidin-1-yl)-[5-[2-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone.

What is the SMILES notation for [5-(3-chlorophenyl)-1,2-oxazol-4-yl]-(3-phenylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;[3-(2-chlorophenyl)pyrrolidin-1-yl]-[5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone;[5-(4-methylphenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;(3-pyridin-3-ylpyrrolidin-1-yl)-[5-[2-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone?

The canonical SMILES for [5-(3-chlorophenyl)-1,2-oxazol-4-yl]-(3-phenylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;[3-(2-chlorophenyl)pyrrolidin-1-yl]-[5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone;[5-(4-methylphenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;(3-pyridin-3-ylpyrrolidin-1-yl)-[5-[2-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone is Cc1ccc(-c2oncc2C(=O)N2CCC(c3ccncc3)C2)cc1.O=C(c1cnoc1-c1ccc(C(F)(F)F)cc1)N1CCC(c2ccccc2Cl)C1.O=C(c1cnoc1-c1ccc(Cl)cc1)N1CCC(c2cccnc2)C1.O=C(c1cnoc1-c1ccc(Cl)cc1)N1CCC(c2ccncc2)C1.O=C(c1cnoc1-c1ccc(Cl)cc1)N1CC[C@@H](c2cccnc2)C1.O=C(c1cnoc1-c1cccc(Cl)c1)N1CCC(c2ccccc2)C1.O=C(c1cnoc1-c1ccccc1C(F)(F)F)N1CCC(c2cccnc2)C1.

What is the InChIKey of [5-(3-chlorophenyl)-1,2-oxazol-4-yl]-(3-phenylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;[3-(2-chlorophenyl)pyrrolidin-1-yl]-[5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone;[5-(4-methylphenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;(3-pyridin-3-ylpyrrolidin-1-yl)-[5-[2-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone?

The InChIKey is OHTLBUCUKKWCDF-DOFCDOPISA-N. The full InChI is InChI=1S/C21H16ClF3N2O2.C20H17ClN2O2.C20H16F3N3O2.C20H19N3O2.3C19H16ClN3O2/c22-18-4-2-1-3-16(18)14-9-10-27(12-14)20(28)17-11-26-29-19(17)13-5-7-15(8-6-13)21(23,24)25;21-17-8-4-7-15(11-17)19-18(12-22-25-19)20(24)23-10-9-16(13-23)14-5-2-1-3-6-14;21-20(22,23)17-6-2-1-5-15(17)18-16(11-25-28-18)19(27)26-9-7-14(12-26)13-4-3-8-24-10-13;1-14-2-4-16(5-3-14)19-18(12-22-25-19)20(24)23-11-8-17(13-23)15-6-9-21-10-7-15;20-16-3-1-14(2-4-16)18-17(11-22-25-18)19(24)23-10-7-15(12-23)13-5-8-21-9-6-13;2*20-16-5-3-13(4-6-16)18-17(11-22-25-18)19(24)23-9-7-15(12-23)14-2-1-8-21-10-14/h1-8,11,14H,9-10,12H2;1-8,11-12,16H,9-10,13H2;1-6,8,10-11,14H,7,9,12H2;2-7,9-10,12,17H,8,11,13H2,1H3;1-6,8-9,11,15H,7,10,12H2;2*1-6,8,10-11,15H,7,9,12H2/t;;;;;15-;/m.....1./s1.

What are the key properties of [5-(3-chlorophenyl)-1,2-oxazol-4-yl]-(3-phenylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;[3-(2-chlorophenyl)pyrrolidin-1-yl]-[5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone;[5-(4-methylphenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;(3-pyridin-3-ylpyrrolidin-1-yl)-[5-[2-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone?

[5-(3-chlorophenyl)-1,2-oxazol-4-yl]-(3-phenylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;[3-(2-chlorophenyl)pyrrolidin-1-yl]-[5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone;[5-(4-methylphenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;(3-pyridin-3-ylpyrrolidin-1-yl)-[5-[2-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone has a molecular weight of 2555.82 g/mol, XLogP of 30.39, 21 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for [5-(3-chlorophenyl)-1,2-oxazol-4-yl]-(3-phenylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-[(3S)-3-pyridin-3-ylpyrrolidin-1-yl]methanone;[5-(4-chlorophenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;[3-(2-chlorophenyl)pyrrolidin-1-yl]-[5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone;[5-(4-methylphenyl)-1,2-oxazol-4-yl]-(3-pyridin-4-ylpyrrolidin-1-yl)methanone;(3-pyridin-3-ylpyrrolidin-1-yl)-[5-[2-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanone is sourced from PubChem (CID 159997752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).