[6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;1,4-dimethyl-3,6-dihydro-2H-pyridine

C66H58BrCl3F9N15O3S3 — CID 159102363

About [6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;1,4-dimethyl-3,6-dihydro-2H-pyridine

[6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;1,4-dimethyl-3,6-dihydro-2H-pyridine (PubChem CID 159102363) has the molecular formula C66H58BrCl3F9N15O3S3 and a molecular weight of 1562.74 g/mol. Its IUPAC name is [6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;1,4-dimethyl-3,6-dihydro-2H-pyridine.

Molecular Properties

• Compound Name: [6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;1,4-dimethyl-3,6-dihydro-2H-pyridine
• PubChem CID: 159102363
• Molecular Formula: C66H58BrCl3F9N15O3S3
• Molecular Weight: 1562.74 g/mol
• Exact Mass: 1559.21
• IUPAC Name: [6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;1,4-dimethyl-3,6-dihydro-2H-pyridine
• SMILES: CC1=CCN(C)CC1.CN1CC=C(c2cc(C(F)(F)F)c3nc(C(=O)N4CC=C(c5nccs5)C4)c(Cl)n3c2)CC1.O=C(c1nc2c(C(F)(F)F)cc(Br)cn2c1Cl)N1CC=C(c2nccs2)C1.O=C(c1nc2c(C(F)(F)F)cc(C3=CCNCC3)cn2c1Cl)N1CC=C(c2nccs2)C1
• InChI: InChI=1S/C22H19ClF3N5OS.C21H17ClF3N5OS.C16H9BrClF3N4OS.C7H13N/c1-29-6-2-13(3-7-29)15-10-16(22(24,25)26)19-28-17(18(23)31(19)12-15)21(32)30-8-4-14(11-30)20-27-5-9-33-20;22-17-16(20(31)29-7-3-13(10-29)19-27-6-8-32-19)28-18-15(21(23,24)25)9-14(11-30(17)18)12-1-4-26-5-2-12;17-9-5-10(16(19,20)21)13-23-11(12(18)25(13)7-9)15(26)24-3-1-8(6-24)14-22-2-4-27-14;1-7-3-5-8(2)6-4-7/h2,4-5,9-10,12H,3,6-8,11H2,1H3;1,3,6,8-9,11,26H,2,4-5,7,10H2;1-2,4-5,7H,3,6H2;3H,4-6H2,1-2H3
• InChIKey: KDLHHFQFOMDGJQ-UHFFFAOYSA-N
• XLogP: 15.13
• TPSA: 170.01 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 18
• Rotatable Bonds: 8
• Heavy Atoms: 100
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1562.74
LogP ≤ 5	15.13
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;1,4-dimethyl-3,6-dihydro-2H-pyridine?

The IUPAC name of [6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;1,4-dimethyl-3,6-dihydro-2H-pyridine (CID 159102363) is [6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;1,4-dimethyl-3,6-dihydro-2H-pyridine.

What is the SMILES notation for [6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;1,4-dimethyl-3,6-dihydro-2H-pyridine?

The canonical SMILES for [6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;1,4-dimethyl-3,6-dihydro-2H-pyridine is CC1=CCN(C)CC1.CN1CC=C(c2cc(C(F)(F)F)c3nc(C(=O)N4CC=C(c5nccs5)C4)c(Cl)n3c2)CC1.O=C(c1nc2c(C(F)(F)F)cc(Br)cn2c1Cl)N1CC=C(c2nccs2)C1.O=C(c1nc2c(C(F)(F)F)cc(C3=CCNCC3)cn2c1Cl)N1CC=C(c2nccs2)C1.

What is the InChIKey of [6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;1,4-dimethyl-3,6-dihydro-2H-pyridine?

The InChIKey is KDLHHFQFOMDGJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19ClF3N5OS.C21H17ClF3N5OS.C16H9BrClF3N4OS.C7H13N/c1-29-6-2-13(3-7-29)15-10-16(22(24,25)26)19-28-17(18(23)31(19)12-15)21(32)30-8-4-14(11-30)20-27-5-9-33-20;22-17-16(20(31)29-7-3-13(10-29)19-27-6-8-32-19)28-18-15(21(23,24)25)9-14(11-30(17)18)12-1-4-26-5-2-12;17-9-5-10(16(19,20)21)13-23-11(12(18)25(13)7-9)15(26)24-3-1-8(6-24)14-22-2-4-27-14;1-7-3-5-8(2)6-4-7/h2,4-5,9-10,12H,3,6-8,11H2,1H3;1,3,6,8-9,11,26H,2,4-5,7,10H2;1-2,4-5,7H,3,6H2;3H,4-6H2,1-2H3.

What are the key properties of [6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;1,4-dimethyl-3,6-dihydro-2H-pyridine?

[6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;1,4-dimethyl-3,6-dihydro-2H-pyridine has a molecular weight of 1562.74 g/mol, XLogP of 15.13, 8 rotatable bonds, 1 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for [6-bromo-3-chloro-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;[3-chloro-6-(1,2,3,6-tetrahydropyridin-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(1,3-thiazol-2-yl)-2,5-dihydropyrrol-1-yl]methanone;1,4-dimethyl-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 159102363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).