tert-butyl N-(benzenesulfonyl)-N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;tert-butyl N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;ethane;3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzenesulfonamide;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;methyl 3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate;toluene

C108H106F22N16O14S3 — CID 161105232

About tert-butyl N-(benzenesulfonyl)-N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;tert-butyl N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;ethane;3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzenesulfonamide;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;methyl 3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate;toluene

tert-butyl N-(benzenesulfonyl)-N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;tert-butyl N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;ethane;3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzenesulfonamide;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;methyl 3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate;toluene (PubChem CID 161105232) has the molecular formula C108H106F22N16O14S3 and a molecular weight of 2366.29 g/mol. Its IUPAC name is tert-butyl N-(benzenesulfonyl)-N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;tert-butyl N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;ethane;3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzenesulfonamide;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;methyl 3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate;toluene.

Molecular Properties

• Compound Name: tert-butyl N-(benzenesulfonyl)-N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;tert-butyl N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;ethane;3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzenesulfonamide;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;methyl 3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate;toluene
• PubChem CID: 161105232
• Molecular Formula: C108H106F22N16O14S3
• Molecular Weight: 2366.29 g/mol
• Exact Mass: 2364.69
• IUPAC Name: tert-butyl N-(benzenesulfonyl)-N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;tert-butyl N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;ethane;3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzenesulfonamide;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;methyl 3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate;toluene
• SMILES: CC.CCc1c(C(=O)O)nc2c(C(F)(F)F)cccn12.CCc1c(C(=O)OC)nc2c(C(F)(F)F)cccn12.CCc1c(N(C(=O)OC(C)(C)C)S(=O)(=O)c2ccccc2)nc2c(C(F)(F)F)cccn12.CCc1c(N(Cc2ccc(F)c(C(F)(F)F)c2)S(=O)(=O)c2ccccc2)nc2c(C(F)(F)F)cccn12.CCc1c(NC(=O)OC(C)(C)C)nc2c(C(F)(F)F)cccn12.CCc1c(NS(=O)(=O)c2ccccc2)nc2c(C(F)(F)F)cccn12.Cc1ccccc1
• InChI: InChI=1S/C24H18F7N3O2S.C21H22F3N3O4S.C16H14F3N3O2S.C15H18F3N3O2.C12H11F3N2O2.C11H9F3N2O2.C7H8.C2H6/c1-2-20-22(32-21-17(23(26,27)28)9-6-12-33(20)21)34(37(35,36)16-7-4-3-5-8-16)14-15-10-11-19(25)18(13-15)24(29,30)31;1-5-16-18(25-17-15(21(22,23)24)12-9-13-26(16)17)27(19(28)31-20(2,3)4)32(29,30)14-10-7-6-8-11-14;1-2-13-14(21-25(23,24)11-7-4-3-5-8-11)20-15-12(16(17,18)19)9-6-10-22(13)15;1-5-10-11(20-13(22)23-14(2,3)4)19-12-9(15(16,17)18)7-6-8-21(10)12;1-3-8-9(11(18)19-2)16-10-7(12(13,14)15)5-4-6-17(8)10;1-2-7-8(10(17)18)15-9-6(11(12,13)14)4-3-5-16(7)9;1-7-5-3-2-4-6-7;1-2/h3-13H,2,14H2,1H3;6-13H,5H2,1-4H3;3-10,21H,2H2,1H3;6-8H,5H2,1-4H3,(H,20,22);4-6H,3H2,1-2H3;3-5H,2H2,1H3,(H,17,18);2-6H,1H3;1-2H3
• InChIKey: UIYSWFGQCUYTBR-UHFFFAOYSA-N
• XLogP: 27.83
• TPSA: 352.96 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 25
• Rotatable Bonds: 20
• Heavy Atoms: 163
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2366.29
LogP ≤ 5	27.83
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(benzenesulfonyl)-N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;tert-butyl N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;ethane;3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzenesulfonamide;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;methyl 3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate;toluene?

The IUPAC name of tert-butyl N-(benzenesulfonyl)-N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;tert-butyl N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;ethane;3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzenesulfonamide;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;methyl 3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate;toluene (CID 161105232) is tert-butyl N-(benzenesulfonyl)-N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;tert-butyl N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;ethane;3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzenesulfonamide;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;methyl 3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate;toluene.

What is the SMILES notation for tert-butyl N-(benzenesulfonyl)-N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;tert-butyl N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;ethane;3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzenesulfonamide;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;methyl 3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate;toluene?

The canonical SMILES for tert-butyl N-(benzenesulfonyl)-N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;tert-butyl N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;ethane;3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzenesulfonamide;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;methyl 3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate;toluene is CC.CCc1c(C(=O)O)nc2c(C(F)(F)F)cccn12.CCc1c(C(=O)OC)nc2c(C(F)(F)F)cccn12.CCc1c(N(C(=O)OC(C)(C)C)S(=O)(=O)c2ccccc2)nc2c(C(F)(F)F)cccn12.CCc1c(N(Cc2ccc(F)c(C(F)(F)F)c2)S(=O)(=O)c2ccccc2)nc2c(C(F)(F)F)cccn12.CCc1c(NC(=O)OC(C)(C)C)nc2c(C(F)(F)F)cccn12.CCc1c(NS(=O)(=O)c2ccccc2)nc2c(C(F)(F)F)cccn12.Cc1ccccc1.

What is the InChIKey of tert-butyl N-(benzenesulfonyl)-N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;tert-butyl N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;ethane;3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzenesulfonamide;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;methyl 3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate;toluene?

The InChIKey is UIYSWFGQCUYTBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18F7N3O2S.C21H22F3N3O4S.C16H14F3N3O2S.C15H18F3N3O2.C12H11F3N2O2.C11H9F3N2O2.C7H8.C2H6/c1-2-20-22(32-21-17(23(26,27)28)9-6-12-33(20)21)34(37(35,36)16-7-4-3-5-8-16)14-15-10-11-19(25)18(13-15)24(29,30)31;1-5-16-18(25-17-15(21(22,23)24)12-9-13-26(16)17)27(19(28)31-20(2,3)4)32(29,30)14-10-7-6-8-11-14;1-2-13-14(21-25(23,24)11-7-4-3-5-8-11)20-15-12(16(17,18)19)9-6-10-22(13)15;1-5-10-11(20-13(22)23-14(2,3)4)19-12-9(15(16,17)18)7-6-8-21(10)12;1-3-8-9(11(18)19-2)16-10-7(12(13,14)15)5-4-6-17(8)10;1-2-7-8(10(17)18)15-9-6(11(12,13)14)4-3-5-16(7)9;1-7-5-3-2-4-6-7;1-2/h3-13H,2,14H2,1H3;6-13H,5H2,1-4H3;3-10,21H,2H2,1H3;6-8H,5H2,1-4H3,(H,20,22);4-6H,3H2,1-2H3;3-5H,2H2,1H3,(H,17,18);2-6H,1H3;1-2H3.

What are the key properties of tert-butyl N-(benzenesulfonyl)-N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;tert-butyl N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;ethane;3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzenesulfonamide;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;methyl 3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate;toluene?

tert-butyl N-(benzenesulfonyl)-N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;tert-butyl N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;ethane;3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzenesulfonamide;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;methyl 3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate;toluene has a molecular weight of 2366.29 g/mol, XLogP of 27.83, 20 rotatable bonds, 3 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl N-(benzenesulfonyl)-N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;tert-butyl N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]carbamate;ethane;3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]benzenesulfonamide;N-[3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;methyl 3-ethyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate;toluene is sourced from PubChem (CID 161105232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).