1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[(3S)-3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]phenyl]propan-1-one;1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(pentafluoro-λ6-sulfanyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-3-[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-(2-hydroxy-2,3-dihydro-1-benzofuran-5-yl)propan-1-one

C134H134Cl3F14N15O11S — CID 160541241

About 1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[(3S)-3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]phenyl]propan-1-one;1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(pentafluoro-λ6-sulfanyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-3-[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-(2-hydroxy-2,3-dihydro-1-benzofuran-5-yl)propan-1-one

1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[(3S)-3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]phenyl]propan-1-one;1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(pentafluoro-λ6-sulfanyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-3-[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-(2-hydroxy-2,3-dihydro-1-benzofuran-5-yl)propan-1-one (PubChem CID 160541241) has the molecular formula C134H134Cl3F14N15O11S and a molecular weight of 2535.04 g/mol. Its IUPAC name is 1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[(3S)-3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]phenyl]propan-1-one;1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(pentafluoro-λ6-sulfanyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-3-[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-(2-hydroxy-2,3-dihydro-1-benzofuran-5-yl)propan-1-one.

Molecular Properties

• Compound Name: 1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[(3S)-3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]phenyl]propan-1-one;1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(pentafluoro-λ6-sulfanyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-3-[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-(2-hydroxy-2,3-dihydro-1-benzofuran-5-yl)propan-1-one
• PubChem CID: 160541241
• Molecular Formula: C134H134Cl3F14N15O11S
• Molecular Weight: 2535.04 g/mol
• Exact Mass: 2531.89
• IUPAC Name: 1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[(3S)-3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]phenyl]propan-1-one;1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(pentafluoro-λ6-sulfanyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-3-[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-(2-hydroxy-2,3-dihydro-1-benzofuran-5-yl)propan-1-one
• SMILES: CCc1nc2ccc(Cl)cn2c1C(=O)CCc1ccc(N2CCC3(CC2)OC[C@H](C)O3)c(F)c1.CCc1nc2ccc(Cl)cn2c1C(=O)CCc1ccc(N2CCCN(c3ccc(S(F)(F)(F)(F)F)cc3)CC2)c(F)c1.Cc1ccn2c(C(=O)CCc3ccc(N4CCC(c5ccc(OC(F)(F)F)cc5)CC4)c(F)c3)c(C)nc2c1.Cc1ccn2c(C(=O)CCc3ccc4c(c3)CC(O)O4)c(C)nc2c1.Cc1nc2ccc(Cl)cn2c1C(=O)CCc1ccc(N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1
• InChI: InChI=1S/C30H29F4N3O2.C29H29ClF6N4OS.C29H27ClF3N3O2.C26H29ClFN3O3.C20H20N2O3/c1-19-11-16-37-28(17-19)35-20(2)29(37)27(38)10-4-21-3-9-26(25(31)18-21)36-14-12-23(13-15-36)22-5-7-24(8-6-22)39-30(32,33)34;1-2-25-29(40-19-21(30)6-13-28(40)37-25)27(41)12-5-20-4-11-26(24(31)18-20)39-15-3-14-38(16-17-39)22-7-9-23(10-8-22)42(32,33,34,35)36;1-19-28(36-18-23(30)7-13-27(36)34-19)26(37)12-4-20-2-8-24(9-3-20)35-16-14-22(15-17-35)21-5-10-25(11-6-21)38-29(31,32)33;1-3-21-25(31-15-19(27)6-9-24(31)29-21)23(32)8-5-18-4-7-22(20(28)14-18)30-12-10-26(11-13-30)33-16-17(2)34-26;1-12-7-8-22-18(9-12)21-13(2)20(22)16(23)5-3-14-4-6-17-15(10-14)11-19(24)25-17/h3,5-9,11,16-18,23H,4,10,12-15H2,1-2H3;4,6-11,13,18-19H,2-3,5,12,14-17H2,1H3;2-3,5-11,13,18,22H,4,12,14-17H2,1H3;4,6-7,9,14-15,17H,3,5,8,10-13,16H2,1-2H3;4,6-10,19,24H,3,5,11H2,1-2H3/t;;;17-;/m...0./s1
• InChIKey: QWUVDIUFRGBMDF-WQRIQYTDSA-N
• XLogP: 31.72
• TPSA: 254.43 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 26
• Rotatable Bonds: 32
• Heavy Atoms: 178
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2535.04
LogP ≤ 5	31.72
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[(3S)-3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]phenyl]propan-1-one;1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(pentafluoro-λ6-sulfanyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-3-[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-(2-hydroxy-2,3-dihydro-1-benzofuran-5-yl)propan-1-one?

The IUPAC name of 1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[(3S)-3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]phenyl]propan-1-one;1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(pentafluoro-λ6-sulfanyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-3-[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-(2-hydroxy-2,3-dihydro-1-benzofuran-5-yl)propan-1-one (CID 160541241) is 1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[(3S)-3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]phenyl]propan-1-one;1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(pentafluoro-λ6-sulfanyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-3-[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-(2-hydroxy-2,3-dihydro-1-benzofuran-5-yl)propan-1-one.

What is the SMILES notation for 1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[(3S)-3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]phenyl]propan-1-one;1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(pentafluoro-λ6-sulfanyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-3-[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-(2-hydroxy-2,3-dihydro-1-benzofuran-5-yl)propan-1-one?

The canonical SMILES for 1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[(3S)-3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]phenyl]propan-1-one;1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(pentafluoro-λ6-sulfanyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-3-[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-(2-hydroxy-2,3-dihydro-1-benzofuran-5-yl)propan-1-one is CCc1nc2ccc(Cl)cn2c1C(=O)CCc1ccc(N2CCC3(CC2)OC[C@H](C)O3)c(F)c1.CCc1nc2ccc(Cl)cn2c1C(=O)CCc1ccc(N2CCCN(c3ccc(S(F)(F)(F)(F)F)cc3)CC2)c(F)c1.Cc1ccn2c(C(=O)CCc3ccc(N4CCC(c5ccc(OC(F)(F)F)cc5)CC4)c(F)c3)c(C)nc2c1.Cc1ccn2c(C(=O)CCc3ccc4c(c3)CC(O)O4)c(C)nc2c1.Cc1nc2ccc(Cl)cn2c1C(=O)CCc1ccc(N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1.

What is the InChIKey of 1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[(3S)-3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]phenyl]propan-1-one;1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(pentafluoro-λ6-sulfanyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-3-[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-(2-hydroxy-2,3-dihydro-1-benzofuran-5-yl)propan-1-one?

The InChIKey is QWUVDIUFRGBMDF-WQRIQYTDSA-N. The full InChI is InChI=1S/C30H29F4N3O2.C29H29ClF6N4OS.C29H27ClF3N3O2.C26H29ClFN3O3.C20H20N2O3/c1-19-11-16-37-28(17-19)35-20(2)29(37)27(38)10-4-21-3-9-26(25(31)18-21)36-14-12-23(13-15-36)22-5-7-24(8-6-22)39-30(32,33)34;1-2-25-29(40-19-21(30)6-13-28(40)37-25)27(41)12-5-20-4-11-26(24(31)18-20)39-15-3-14-38(16-17-39)22-7-9-23(10-8-22)42(32,33,34,35)36;1-19-28(36-18-23(30)7-13-27(36)34-19)26(37)12-4-20-2-8-24(9-3-20)35-16-14-22(15-17-35)21-5-10-25(11-6-21)38-29(31,32)33;1-3-21-25(31-15-19(27)6-9-24(31)29-21)23(32)8-5-18-4-7-22(20(28)14-18)30-12-10-26(11-13-30)33-16-17(2)34-26;1-12-7-8-22-18(9-12)21-13(2)20(22)16(23)5-3-14-4-6-17-15(10-14)11-19(24)25-17/h3,5-9,11,16-18,23H,4,10,12-15H2,1-2H3;4,6-11,13,18-19H,2-3,5,12,14-17H2,1H3;2-3,5-11,13,18,22H,4,12,14-17H2,1H3;4,6-7,9,14-15,17H,3,5,8,10-13,16H2,1-2H3;4,6-10,19,24H,3,5,11H2,1-2H3/t;;;17-;/m...0./s1.

What are the key properties of 1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[(3S)-3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]phenyl]propan-1-one;1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(pentafluoro-λ6-sulfanyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-3-[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-(2-hydroxy-2,3-dihydro-1-benzofuran-5-yl)propan-1-one?

1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[(3S)-3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]phenyl]propan-1-one;1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(pentafluoro-λ6-sulfanyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-3-[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-(2-hydroxy-2,3-dihydro-1-benzofuran-5-yl)propan-1-one has a molecular weight of 2535.04 g/mol, XLogP of 31.72, 32 rotatable bonds, 1 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[(3S)-3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]phenyl]propan-1-one;1-(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(pentafluoro-λ6-sulfanyl)phenyl]-1,4-diazepan-1-yl]phenyl]propan-1-one;1-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-3-[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-[3-fluoro-4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]propan-1-one;1-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-3-(2-hydroxy-2,3-dihydro-1-benzofuran-5-yl)propan-1-one is sourced from PubChem (CID 160541241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).