2-bromo-N,N-dimethylimidazole-1-sulfonamide;2-bromo-1H-imidazole;tert-butyl 4-[1-(dimethylsulfamoyl)imidazol-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(1H-imidazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone;N,N-dimethylsulfamoyl chloride;N,N-dimethyl-2-(1,2,3,6-tetrahydropyridin-4-yl)imidazole-1-sulfonamide;hydrochloride

C85H107BBr2Cl4F6N22O19S4 — CID 159771339

About 2-bromo-N,N-dimethylimidazole-1-sulfonamide;2-bromo-1H-imidazole;tert-butyl 4-[1-(dimethylsulfamoyl)imidazol-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(1H-imidazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone;N,N-dimethylsulfamoyl chloride;N,N-dimethyl-2-(1,2,3,6-tetrahydropyridin-4-yl)imidazole-1-sulfonamide;hydrochloride

2-bromo-N,N-dimethylimidazole-1-sulfonamide;2-bromo-1H-imidazole;tert-butyl 4-[1-(dimethylsulfamoyl)imidazol-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(1H-imidazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone;N,N-dimethylsulfamoyl chloride;N,N-dimethyl-2-(1,2,3,6-tetrahydropyridin-4-yl)imidazole-1-sulfonamide;hydrochloride (PubChem CID 159771339) has the molecular formula C85H107BBr2Cl4F6N22O19S4 and a molecular weight of 2295.61 g/mol. Its IUPAC name is 2-bromo-N,N-dimethylimidazole-1-sulfonamide;2-bromo-1H-imidazole;tert-butyl 4-[1-(dimethylsulfamoyl)imidazol-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(1H-imidazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone;N,N-dimethylsulfamoyl chloride;N,N-dimethyl-2-(1,2,3,6-tetrahydropyridin-4-yl)imidazole-1-sulfonamide;hydrochloride.

Molecular Properties

• Compound Name: 2-bromo-N,N-dimethylimidazole-1-sulfonamide;2-bromo-1H-imidazole;tert-butyl 4-[1-(dimethylsulfamoyl)imidazol-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(1H-imidazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone;N,N-dimethylsulfamoyl chloride;N,N-dimethyl-2-(1,2,3,6-tetrahydropyridin-4-yl)imidazole-1-sulfonamide;hydrochloride
• PubChem CID: 159771339
• Molecular Formula: C85H107BBr2Cl4F6N22O19S4
• Molecular Weight: 2295.61 g/mol
• Exact Mass: 2290.41
• IUPAC Name: 2-bromo-N,N-dimethylimidazole-1-sulfonamide;2-bromo-1H-imidazole;tert-butyl 4-[1-(dimethylsulfamoyl)imidazol-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(1H-imidazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone;N,N-dimethylsulfamoyl chloride;N,N-dimethyl-2-(1,2,3,6-tetrahydropyridin-4-yl)imidazole-1-sulfonamide;hydrochloride
• SMILES: Brc1ncc[nH]1.CC(C)(C)OC(=O)N1CC=C(B2OC(C)(C)C(C)(C)O2)CC1.CN(C)S(=O)(=O)Cl.CN(C)S(=O)(=O)n1ccnc1Br.CN(C)S(=O)(=O)n1ccnc1C1=CCN(C(=O)OC(C)(C)C)CC1.CN(C)S(=O)(=O)n1ccnc1C1=CCNCC1.Cl.O=C(O)c1nc2c(C(F)(F)F)cc(-c3ccoc3)cn2c1Cl.O=C(c1nc2c(C(F)(F)F)cc(-c3ccoc3)cn2c1Cl)N1CC=C(c2ncc[nH]2)CC1
• InChI: InChI=1S/C21H15ClF3N5O2.C16H28BNO4.C15H24N4O4S.C13H6ClF3N2O3.C10H16N4O2S.C5H8BrN3O2S.C3H3BrN2.C2H6ClNO2S.ClH/c22-17-16(20(31)29-6-1-12(2-7-29)18-26-4-5-27-18)28-19-15(21(23,24)25)9-14(10-30(17)19)13-3-8-32-11-13;1-14(2,3)20-13(19)18-10-8-12(9-11-18)17-21-15(4,5)16(6,7)22-17;1-15(2,3)23-14(20)18-9-6-12(7-10-18)13-16-8-11-19(13)24(21,22)17(4)5;14-10-9(12(20)21)18-11-8(13(15,16)17)3-7(4-19(10)11)6-1-2-22-5-6;1-13(2)17(15,16)14-8-7-12-10(14)9-3-5-11-6-4-9;1-8(2)12(10,11)9-4-3-7-5(9)6;4-3-5-1-2-6-3;1-4(2)7(3,5)6;/h1,3-5,8-11H,2,6-7H2,(H,26,27);8H,9-11H2,1-7H3;6,8,11H,7,9-10H2,1-5H3;1-5H,(H,20,21);3,7-8,11H,4-6H2,1-2H3;3-4H,1-2H3;1-2H,(H,5,6);1-2H3;1H
• InChIKey: GWNPNELSVUANLL-UHFFFAOYSA-N
• XLogP: 15.47
• TPSA: 468.40 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 31
• Rotatable Bonds: 15
• Heavy Atoms: 143
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2295.61
LogP ≤ 5	15.47
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N,N-dimethylimidazole-1-sulfonamide;2-bromo-1H-imidazole;tert-butyl 4-[1-(dimethylsulfamoyl)imidazol-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(1H-imidazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone;N,N-dimethylsulfamoyl chloride;N,N-dimethyl-2-(1,2,3,6-tetrahydropyridin-4-yl)imidazole-1-sulfonamide;hydrochloride?

The IUPAC name of 2-bromo-N,N-dimethylimidazole-1-sulfonamide;2-bromo-1H-imidazole;tert-butyl 4-[1-(dimethylsulfamoyl)imidazol-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(1H-imidazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone;N,N-dimethylsulfamoyl chloride;N,N-dimethyl-2-(1,2,3,6-tetrahydropyridin-4-yl)imidazole-1-sulfonamide;hydrochloride (CID 159771339) is 2-bromo-N,N-dimethylimidazole-1-sulfonamide;2-bromo-1H-imidazole;tert-butyl 4-[1-(dimethylsulfamoyl)imidazol-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(1H-imidazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone;N,N-dimethylsulfamoyl chloride;N,N-dimethyl-2-(1,2,3,6-tetrahydropyridin-4-yl)imidazole-1-sulfonamide;hydrochloride.

What is the SMILES notation for 2-bromo-N,N-dimethylimidazole-1-sulfonamide;2-bromo-1H-imidazole;tert-butyl 4-[1-(dimethylsulfamoyl)imidazol-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(1H-imidazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone;N,N-dimethylsulfamoyl chloride;N,N-dimethyl-2-(1,2,3,6-tetrahydropyridin-4-yl)imidazole-1-sulfonamide;hydrochloride?

The canonical SMILES for 2-bromo-N,N-dimethylimidazole-1-sulfonamide;2-bromo-1H-imidazole;tert-butyl 4-[1-(dimethylsulfamoyl)imidazol-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(1H-imidazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone;N,N-dimethylsulfamoyl chloride;N,N-dimethyl-2-(1,2,3,6-tetrahydropyridin-4-yl)imidazole-1-sulfonamide;hydrochloride is Brc1ncc[nH]1.CC(C)(C)OC(=O)N1CC=C(B2OC(C)(C)C(C)(C)O2)CC1.CN(C)S(=O)(=O)Cl.CN(C)S(=O)(=O)n1ccnc1Br.CN(C)S(=O)(=O)n1ccnc1C1=CCN(C(=O)OC(C)(C)C)CC1.CN(C)S(=O)(=O)n1ccnc1C1=CCNCC1.Cl.O=C(O)c1nc2c(C(F)(F)F)cc(-c3ccoc3)cn2c1Cl.O=C(c1nc2c(C(F)(F)F)cc(-c3ccoc3)cn2c1Cl)N1CC=C(c2ncc[nH]2)CC1.

What is the InChIKey of 2-bromo-N,N-dimethylimidazole-1-sulfonamide;2-bromo-1H-imidazole;tert-butyl 4-[1-(dimethylsulfamoyl)imidazol-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(1H-imidazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone;N,N-dimethylsulfamoyl chloride;N,N-dimethyl-2-(1,2,3,6-tetrahydropyridin-4-yl)imidazole-1-sulfonamide;hydrochloride?

The InChIKey is GWNPNELSVUANLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15ClF3N5O2.C16H28BNO4.C15H24N4O4S.C13H6ClF3N2O3.C10H16N4O2S.C5H8BrN3O2S.C3H3BrN2.C2H6ClNO2S.ClH/c22-17-16(20(31)29-6-1-12(2-7-29)18-26-4-5-27-18)28-19-15(21(23,24)25)9-14(10-30(17)19)13-3-8-32-11-13;1-14(2,3)20-13(19)18-10-8-12(9-11-18)17-21-15(4,5)16(6,7)22-17;1-15(2,3)23-14(20)18-9-6-12(7-10-18)13-16-8-11-19(13)24(21,22)17(4)5;14-10-9(12(20)21)18-11-8(13(15,16)17)3-7(4-19(10)11)6-1-2-22-5-6;1-13(2)17(15,16)14-8-7-12-10(14)9-3-5-11-6-4-9;1-8(2)12(10,11)9-4-3-7-5(9)6;4-3-5-1-2-6-3;1-4(2)7(3,5)6;/h1,3-5,8-11H,2,6-7H2,(H,26,27);8H,9-11H2,1-7H3;6,8,11H,7,9-10H2,1-5H3;1-5H,(H,20,21);3,7-8,11H,4-6H2,1-2H3;3-4H,1-2H3;1-2H,(H,5,6);1-2H3;1H.

What are the key properties of 2-bromo-N,N-dimethylimidazole-1-sulfonamide;2-bromo-1H-imidazole;tert-butyl 4-[1-(dimethylsulfamoyl)imidazol-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(1H-imidazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone;N,N-dimethylsulfamoyl chloride;N,N-dimethyl-2-(1,2,3,6-tetrahydropyridin-4-yl)imidazole-1-sulfonamide;hydrochloride?

2-bromo-N,N-dimethylimidazole-1-sulfonamide;2-bromo-1H-imidazole;tert-butyl 4-[1-(dimethylsulfamoyl)imidazol-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(1H-imidazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone;N,N-dimethylsulfamoyl chloride;N,N-dimethyl-2-(1,2,3,6-tetrahydropyridin-4-yl)imidazole-1-sulfonamide;hydrochloride has a molecular weight of 2295.61 g/mol, XLogP of 15.47, 15 rotatable bonds, 4 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 2-bromo-N,N-dimethylimidazole-1-sulfonamide;2-bromo-1H-imidazole;tert-butyl 4-[1-(dimethylsulfamoyl)imidazol-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid;[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(1H-imidazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone;N,N-dimethylsulfamoyl chloride;N,N-dimethyl-2-(1,2,3,6-tetrahydropyridin-4-yl)imidazole-1-sulfonamide;hydrochloride is sourced from PubChem (CID 159771339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).