N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-(1,1-dioxo-1,2-thiazolidin-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one

C93H95Cl4N19O9S2 — CID 161073933

About N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-(1,1-dioxo-1,2-thiazolidin-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one

N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-(1,1-dioxo-1,2-thiazolidin-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one (PubChem CID 161073933) has the molecular formula C93H95Cl4N19O9S2 and a molecular weight of 1828.85 g/mol. Its IUPAC name is N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-(1,1-dioxo-1,2-thiazolidin-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one.

Molecular Properties

• Compound Name: N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-(1,1-dioxo-1,2-thiazolidin-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one
• PubChem CID: 161073933
• Molecular Formula: C93H95Cl4N19O9S2
• Molecular Weight: 1828.85 g/mol
• Exact Mass: 1825.58
• IUPAC Name: N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-(1,1-dioxo-1,2-thiazolidin-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one
• SMILES: CC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(N(C)S(C)(=O)=O)cn23)CC1.COCC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(N4CCCS4(=O)=O)cn23)CC1.O=C(c1c(-c2ccc(Cl)cc2)nc2ccc(-c3ccccc3)cn12)N1CCNCC1.O=C1CN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccn4)cn23)CCN1
• InChI: InChI=1S/C24H28ClN5O4S.C24H21ClN4O.C23H20ClN5O.C22H26ClN5O3S/c1-34-17-23(31)28-12-10-27(11-13-28)16-21-24(18-3-5-19(25)6-4-18)26-22-8-7-20(15-29(21)22)30-9-2-14-35(30,32)33;25-20-9-6-18(7-10-20)22-23(24(30)28-14-12-26-13-15-28)29-16-19(8-11-21(29)27-22)17-4-2-1-3-5-17;24-18-7-4-16(5-8-18)23-20(14-28-12-11-26-22(30)15-28)29-13-17(6-9-21(29)27-23)19-3-1-2-10-25-19;1-16(29)27-12-10-26(11-13-27)15-20-22(17-4-6-18(23)7-5-17)24-21-9-8-19(14-28(20)21)25(2)32(3,30)31/h3-8,15H,2,9-14,16-17H2,1H3;1-11,16,26H,12-15H2;1-10,13H,11-12,14-15H2,(H,26,30);4-9,14H,10-13,15H2,1-3H3
• InChIKey: UFAAYGMIGRHDIB-UHFFFAOYSA-N
• XLogP: 13.22
• TPSA: 277.86 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 22
• Rotatable Bonds: 18
• Heavy Atoms: 127
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1828.85
LogP ≤ 5	13.22
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-(1,1-dioxo-1,2-thiazolidin-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one?

The IUPAC name of N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-(1,1-dioxo-1,2-thiazolidin-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one (CID 161073933) is N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-(1,1-dioxo-1,2-thiazolidin-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one.

What is the SMILES notation for N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-(1,1-dioxo-1,2-thiazolidin-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one?

The canonical SMILES for N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-(1,1-dioxo-1,2-thiazolidin-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one is CC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(N(C)S(C)(=O)=O)cn23)CC1.COCC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(N4CCCS4(=O)=O)cn23)CC1.O=C(c1c(-c2ccc(Cl)cc2)nc2ccc(-c3ccccc3)cn12)N1CCNCC1.O=C1CN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccn4)cn23)CCN1.

What is the InChIKey of N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-(1,1-dioxo-1,2-thiazolidin-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one?

The InChIKey is UFAAYGMIGRHDIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28ClN5O4S.C24H21ClN4O.C23H20ClN5O.C22H26ClN5O3S/c1-34-17-23(31)28-12-10-27(11-13-28)16-21-24(18-3-5-19(25)6-4-18)26-22-8-7-20(15-29(21)22)30-9-2-14-35(30,32)33;25-20-9-6-18(7-10-20)22-23(24(30)28-14-12-26-13-15-28)29-16-19(8-11-21(29)27-22)17-4-2-1-3-5-17;24-18-7-4-16(5-8-18)23-20(14-28-12-11-26-22(30)15-28)29-13-17(6-9-21(29)27-23)19-3-1-2-10-25-19;1-16(29)27-12-10-26(11-13-27)15-20-22(17-4-6-18(23)7-5-17)24-21-9-8-19(14-28(20)21)25(2)32(3,30)31/h3-8,15H,2,9-14,16-17H2,1H3;1-11,16,26H,12-15H2;1-10,13H,11-12,14-15H2,(H,26,30);4-9,14H,10-13,15H2,1-3H3.

What are the key properties of N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-(1,1-dioxo-1,2-thiazolidin-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one?

N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-(1,1-dioxo-1,2-thiazolidin-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one has a molecular weight of 1828.85 g/mol, XLogP of 13.22, 18 rotatable bonds, 2 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-(1,1-dioxo-1,2-thiazolidin-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone;4-[[2-(4-chlorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one is sourced from PubChem (CID 161073933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).