4-[8-(3-fluoro-4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine;N-[4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]phenyl]acetamide;N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine

C88H90FN23O5S — CID 159342243

About 4-[8-(3-fluoro-4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine;N-[4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]phenyl]acetamide;N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine

4-[8-(3-fluoro-4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine;N-[4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]phenyl]acetamide;N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine (PubChem CID 159342243) has the molecular formula C88H90FN23O5S and a molecular weight of 1600.91 g/mol. Its IUPAC name is 4-[8-(3-fluoro-4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine;N-[4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]phenyl]acetamide;N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine.

Molecular Properties

• Compound Name: 4-[8-(3-fluoro-4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine;N-[4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]phenyl]acetamide;N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine
• PubChem CID: 159342243
• Molecular Formula: C88H90FN23O5S
• Molecular Weight: 1600.91 g/mol
• Exact Mass: 1599.72
• IUPAC Name: 4-[8-(3-fluoro-4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine;N-[4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]phenyl]acetamide;N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine
• SMILES: CC(=O)Nc1ccc(-c2ccc(Nc3ccc(S(C)(=O)=O)cc3)c3nccn23)cc1.CC(C)N1CCN(c2ccc(Nc3ccc(-c4cn[nH]c4)n4ccnc34)cc2)CC1.CN1CCN(c2ccc(Nc3ccc(-c4cn[nH]c4)n4ccnc34)cc2)CC1.O=c1cc(-c2ccc(Nc3ccc(N4CCOCC4)c(F)c3)c3nccn23)cc[nH]1
• InChI: InChI=1S/C23H27N7.C22H20FN5O2.C22H20N4O3S.C21H23N7/c1-17(2)28-11-13-29(14-12-28)20-5-3-19(4-6-20)27-21-7-8-22(18-15-25-26-16-18)30-10-9-24-23(21)30;23-17-14-16(1-3-20(17)27-9-11-30-12-10-27)26-18-2-4-19(28-8-7-25-22(18)28)15-5-6-24-21(29)13-15;1-15(27)24-17-5-3-16(4-6-17)21-12-11-20(22-23-13-14-26(21)22)25-18-7-9-19(10-8-18)30(2,28)29;1-26-10-12-27(13-11-26)18-4-2-17(3-5-18)25-19-6-7-20(16-14-23-24-15-16)28-9-8-22-21(19)28/h3-10,15-17,27H,11-14H2,1-2H3,(H,25,26);1-8,13-14,26H,9-12H2,(H,24,29);3-14,25H,1-2H3,(H,24,27);2-9,14-15,25H,10-13H2,1H3,(H,23,24)
• InChIKey: LGGYNVNARHMLBF-UHFFFAOYSA-N
• XLogP: 14.73
• TPSA: 296.21 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 24
• Rotatable Bonds: 18
• Heavy Atoms: 118
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1600.91
LogP ≤ 5	14.73
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[8-(3-fluoro-4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine;N-[4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]phenyl]acetamide;N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine?

The IUPAC name of 4-[8-(3-fluoro-4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine;N-[4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]phenyl]acetamide;N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine (CID 159342243) is 4-[8-(3-fluoro-4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine;N-[4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]phenyl]acetamide;N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine.

What is the SMILES notation for 4-[8-(3-fluoro-4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine;N-[4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]phenyl]acetamide;N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine?

The canonical SMILES for 4-[8-(3-fluoro-4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine;N-[4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]phenyl]acetamide;N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine is CC(=O)Nc1ccc(-c2ccc(Nc3ccc(S(C)(=O)=O)cc3)c3nccn23)cc1.CC(C)N1CCN(c2ccc(Nc3ccc(-c4cn[nH]c4)n4ccnc34)cc2)CC1.CN1CCN(c2ccc(Nc3ccc(-c4cn[nH]c4)n4ccnc34)cc2)CC1.O=c1cc(-c2ccc(Nc3ccc(N4CCOCC4)c(F)c3)c3nccn23)cc[nH]1.

What is the InChIKey of 4-[8-(3-fluoro-4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine;N-[4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]phenyl]acetamide;N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine?

The InChIKey is LGGYNVNARHMLBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N7.C22H20FN5O2.C22H20N4O3S.C21H23N7/c1-17(2)28-11-13-29(14-12-28)20-5-3-19(4-6-20)27-21-7-8-22(18-15-25-26-16-18)30-10-9-24-23(21)30;23-17-14-16(1-3-20(17)27-9-11-30-12-10-27)26-18-2-4-19(28-8-7-25-22(18)28)15-5-6-24-21(29)13-15;1-15(27)24-17-5-3-16(4-6-17)21-12-11-20(22-23-13-14-26(21)22)25-18-7-9-19(10-8-18)30(2,28)29;1-26-10-12-27(13-11-26)18-4-2-17(3-5-18)25-19-6-7-20(16-14-23-24-15-16)28-9-8-22-21(19)28/h3-10,15-17,27H,11-14H2,1-2H3,(H,25,26);1-8,13-14,26H,9-12H2,(H,24,29);3-14,25H,1-2H3,(H,24,27);2-9,14-15,25H,10-13H2,1H3,(H,23,24).

What are the key properties of 4-[8-(3-fluoro-4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine;N-[4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]phenyl]acetamide;N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine?

4-[8-(3-fluoro-4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine;N-[4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]phenyl]acetamide;N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine has a molecular weight of 1600.91 g/mol, XLogP of 14.73, 18 rotatable bonds, 8 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[8-(3-fluoro-4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine;N-[4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]phenyl]acetamide;N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]-5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-8-amine is sourced from PubChem (CID 159342243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).