[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-3-ylmethanone;3-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]-5-fluoro-1,2-benzoxazole;4-[[6-phenyl-2-[4-(4H-triazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine

C118H102Cl3FN20O4 — CID 161281462

About [4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-3-ylmethanone;3-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]-5-fluoro-1,2-benzoxazole;4-[[6-phenyl-2-[4-(4H-triazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine

[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-3-ylmethanone;3-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]-5-fluoro-1,2-benzoxazole;4-[[6-phenyl-2-[4-(4H-triazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine (PubChem CID 161281462) has the molecular formula C118H102Cl3FN20O4 and a molecular weight of 1989.61 g/mol. Its IUPAC name is [4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-3-ylmethanone;3-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]-5-fluoro-1,2-benzoxazole;4-[[6-phenyl-2-[4-(4H-triazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine.

Molecular Properties

• Compound Name: [4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-3-ylmethanone;3-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]-5-fluoro-1,2-benzoxazole;4-[[6-phenyl-2-[4-(4H-triazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine
• PubChem CID: 161281462
• Molecular Formula: C118H102Cl3FN20O4
• Molecular Weight: 1989.61 g/mol
• Exact Mass: 1986.74
• IUPAC Name: [4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-3-ylmethanone;3-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]-5-fluoro-1,2-benzoxazole;4-[[6-phenyl-2-[4-(4H-triazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine
• SMILES: Fc1ccc2onc(C3CCN(Cc4c(-c5ccc(Cl)cc5)nc5ccc(-c6ccccc6)cn45)CC3)c2c1.O=C(c1ccccn1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.O=C(c1cccnc1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.c1ccc(-c2ccc3nc(-c4ccc(C5=NN=NC5)cc4)c(CN4CCOCC4)n3c2)cc1
• InChI: InChI=1S/C32H26ClFN4O.2C30H26ClN5O.C26H24N6O/c33-25-9-6-22(7-10-25)32-28(38-19-24(8-13-30(38)35-32)21-4-2-1-3-5-21)20-37-16-14-23(15-17-37)31-27-18-26(34)11-12-29(27)39-36-31;31-25-12-9-23(10-13-25)29-27(36-20-24(11-14-28(36)33-29)22-6-2-1-3-7-22)21-34-16-18-35(19-17-34)30(37)26-8-4-5-15-32-26;31-26-11-8-23(9-12-26)29-27(36-20-25(10-13-28(36)33-29)22-5-2-1-3-6-22)21-34-15-17-35(18-16-34)30(37)24-7-4-14-32-19-24;1-2-4-19(5-3-1)22-10-11-25-28-26(21-8-6-20(7-9-21)23-16-27-30-29-23)24(32(25)17-22)18-31-12-14-33-15-13-31/h1-13,18-19,23H,14-17,20H2;1-15,20H,16-19,21H2;1-14,19-20H,15-18,21H2;1-11,17H,12-16,18H2
• InChIKey: VFDLLIFJNGLVKC-UHFFFAOYSA-N
• XLogP: 24.00
• TPSA: 220.90 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 20
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1989.61
LogP ≤ 5	24.00
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of [4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-3-ylmethanone;3-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]-5-fluoro-1,2-benzoxazole;4-[[6-phenyl-2-[4-(4H-triazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine?

The IUPAC name of [4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-3-ylmethanone;3-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]-5-fluoro-1,2-benzoxazole;4-[[6-phenyl-2-[4-(4H-triazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine (CID 161281462) is [4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-3-ylmethanone;3-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]-5-fluoro-1,2-benzoxazole;4-[[6-phenyl-2-[4-(4H-triazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine.

What is the SMILES notation for [4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-3-ylmethanone;3-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]-5-fluoro-1,2-benzoxazole;4-[[6-phenyl-2-[4-(4H-triazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine?

The canonical SMILES for [4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-3-ylmethanone;3-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]-5-fluoro-1,2-benzoxazole;4-[[6-phenyl-2-[4-(4H-triazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine is Fc1ccc2onc(C3CCN(Cc4c(-c5ccc(Cl)cc5)nc5ccc(-c6ccccc6)cn45)CC3)c2c1.O=C(c1ccccn1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.O=C(c1cccnc1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.c1ccc(-c2ccc3nc(-c4ccc(C5=NN=NC5)cc4)c(CN4CCOCC4)n3c2)cc1.

What is the InChIKey of [4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-3-ylmethanone;3-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]-5-fluoro-1,2-benzoxazole;4-[[6-phenyl-2-[4-(4H-triazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine?

The InChIKey is VFDLLIFJNGLVKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H26ClFN4O.2C30H26ClN5O.C26H24N6O/c33-25-9-6-22(7-10-25)32-28(38-19-24(8-13-30(38)35-32)21-4-2-1-3-5-21)20-37-16-14-23(15-17-37)31-27-18-26(34)11-12-29(27)39-36-31;31-25-12-9-23(10-13-25)29-27(36-20-24(11-14-28(36)33-29)22-6-2-1-3-7-22)21-34-16-18-35(19-17-34)30(37)26-8-4-5-15-32-26;31-26-11-8-23(9-12-26)29-27(36-20-25(10-13-28(36)33-29)22-5-2-1-3-6-22)21-34-15-17-35(18-16-34)30(37)24-7-4-14-32-19-24;1-2-4-19(5-3-1)22-10-11-25-28-26(21-8-6-20(7-9-21)23-16-27-30-29-23)24(32(25)17-22)18-31-12-14-33-15-13-31/h1-13,18-19,23H,14-17,20H2;1-15,20H,16-19,21H2;1-14,19-20H,15-18,21H2;1-11,17H,12-16,18H2.

What are the key properties of [4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-3-ylmethanone;3-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]-5-fluoro-1,2-benzoxazole;4-[[6-phenyl-2-[4-(4H-triazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine?

[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-3-ylmethanone;3-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]-5-fluoro-1,2-benzoxazole;4-[[6-phenyl-2-[4-(4H-triazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine has a molecular weight of 1989.61 g/mol, XLogP of 24.00, 20 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for [4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-3-ylmethanone;3-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]-5-fluoro-1,2-benzoxazole;4-[[6-phenyl-2-[4-(4H-triazol-5-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine is sourced from PubChem (CID 161281462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).