4-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[2-(4-chlorophenyl)-3-[(4-propanoylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyrazine-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyridine-4-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile

C121H101Cl4N23O4 — CID 160917453

About 4-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[2-(4-chlorophenyl)-3-[(4-propanoylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyrazine-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyridine-4-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile

4-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[2-(4-chlorophenyl)-3-[(4-propanoylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyrazine-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyridine-4-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile (PubChem CID 160917453) has the molecular formula C121H101Cl4N23O4 and a molecular weight of 2083.11 g/mol. Its IUPAC name is 4-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[2-(4-chlorophenyl)-3-[(4-propanoylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyrazine-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyridine-4-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile.

Molecular Properties

• Compound Name: 4-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[2-(4-chlorophenyl)-3-[(4-propanoylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyrazine-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyridine-4-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile
• PubChem CID: 160917453
• Molecular Formula: C121H101Cl4N23O4
• Molecular Weight: 2083.11 g/mol
• Exact Mass: 2079.72
• IUPAC Name: 4-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[2-(4-chlorophenyl)-3-[(4-propanoylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyrazine-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyridine-4-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile
• SMILES: CCC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4C#N)cn23)CC1.N#Cc1ccc(C(=O)N2CCN(Cc3c(-c4ccc(Cl)cc4)nc4ccc(-c5ccccc5)cn34)CC2)cc1.N#Cc1ccccc1-c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCN(C(=O)c4ccncc4)CC3)n2c1.N#Cc1ccccc1-c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCN(C(=O)c4cnccn4)CC3)n2c1
• InChI: InChI=1S/C32H26ClN5O.C31H25ClN6O.C30H24ClN7O.C28H26ClN5O/c33-28-13-10-25(11-14-28)31-29(38-21-27(12-15-30(38)35-31)24-4-2-1-3-5-24)22-36-16-18-37(19-17-36)32(39)26-8-6-23(20-34)7-9-26;32-26-8-5-22(6-9-26)30-28(21-36-15-17-37(18-16-36)31(39)23-11-13-34-14-12-23)38-20-25(7-10-29(38)35-30)27-4-2-1-3-24(27)19-33;31-24-8-5-21(6-9-24)29-27(20-36-13-15-37(16-14-36)30(39)26-18-33-11-12-34-26)38-19-23(7-10-28(38)35-29)25-4-2-1-3-22(25)17-32;1-2-27(35)33-15-13-32(14-16-33)19-25-28(20-7-10-23(29)11-8-20)31-26-12-9-22(18-34(25)26)24-6-4-3-5-21(24)17-30/h1-15,21H,16-19,22H2;1-14,20H,15-18,21H2;1-12,18-19H,13-16,20H2;3-12,18H,2,13-16,19H2,1H3
• InChIKey: SROZFNFDNAVGEW-UHFFFAOYSA-N
• XLogP: 21.89
• TPSA: 297.23 Ų
• H-Bond Acceptors: 23
• Rotatable Bonds: 20
• Heavy Atoms: 152
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2083.11
LogP ≤ 5	21.89
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of 4-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[2-(4-chlorophenyl)-3-[(4-propanoylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyrazine-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyridine-4-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile?

The IUPAC name of 4-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[2-(4-chlorophenyl)-3-[(4-propanoylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyrazine-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyridine-4-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile (CID 160917453) is 4-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[2-(4-chlorophenyl)-3-[(4-propanoylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyrazine-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyridine-4-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile.

What is the SMILES notation for 4-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[2-(4-chlorophenyl)-3-[(4-propanoylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyrazine-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyridine-4-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile?

The canonical SMILES for 4-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[2-(4-chlorophenyl)-3-[(4-propanoylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyrazine-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyridine-4-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile is CCC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4C#N)cn23)CC1.N#Cc1ccc(C(=O)N2CCN(Cc3c(-c4ccc(Cl)cc4)nc4ccc(-c5ccccc5)cn34)CC2)cc1.N#Cc1ccccc1-c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCN(C(=O)c4ccncc4)CC3)n2c1.N#Cc1ccccc1-c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCN(C(=O)c4cnccn4)CC3)n2c1.

What is the InChIKey of 4-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[2-(4-chlorophenyl)-3-[(4-propanoylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyrazine-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyridine-4-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile?

The InChIKey is SROZFNFDNAVGEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H26ClN5O.C31H25ClN6O.C30H24ClN7O.C28H26ClN5O/c33-28-13-10-25(11-14-28)31-29(38-21-27(12-15-30(38)35-31)24-4-2-1-3-5-24)22-36-16-18-37(19-17-36)32(39)26-8-6-23(20-34)7-9-26;32-26-8-5-22(6-9-26)30-28(21-36-15-17-37(18-16-36)31(39)23-11-13-34-14-12-23)38-20-25(7-10-29(38)35-30)27-4-2-1-3-24(27)19-33;31-24-8-5-21(6-9-24)29-27(20-36-13-15-37(16-14-36)30(39)26-18-33-11-12-34-26)38-19-23(7-10-28(38)35-29)25-4-2-1-3-22(25)17-32;1-2-27(35)33-15-13-32(14-16-33)19-25-28(20-7-10-23(29)11-8-20)31-26-12-9-22(18-34(25)26)24-6-4-3-5-21(24)17-30/h1-15,21H,16-19,22H2;1-14,20H,15-18,21H2;1-12,18-19H,13-16,20H2;3-12,18H,2,13-16,19H2,1H3.

What are the key properties of 4-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[2-(4-chlorophenyl)-3-[(4-propanoylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyrazine-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyridine-4-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile?

4-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[2-(4-chlorophenyl)-3-[(4-propanoylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyrazine-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyridine-4-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile has a molecular weight of 2083.11 g/mol, XLogP of 21.89, 20 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carbonyl]benzonitrile;2-[2-(4-chlorophenyl)-3-[(4-propanoylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyrazine-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;2-[2-(4-chlorophenyl)-3-[[4-(pyridine-4-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile is sourced from PubChem (CID 160917453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).