5-(6-amino-3-pyridinyl)-N-(3-fluoro-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;2-chloro-4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one

C90H87ClFN21O7S — CID 157378188

About 5-(6-amino-3-pyridinyl)-N-(3-fluoro-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;2-chloro-4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one

5-(6-amino-3-pyridinyl)-N-(3-fluoro-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;2-chloro-4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one (PubChem CID 157378188) has the molecular formula C90H87ClFN21O7S and a molecular weight of 1661.34 g/mol. Its IUPAC name is 5-(6-amino-3-pyridinyl)-N-(3-fluoro-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;2-chloro-4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one.

Molecular Properties

• Compound Name: 5-(6-amino-3-pyridinyl)-N-(3-fluoro-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;2-chloro-4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one
• PubChem CID: 157378188
• Molecular Formula: C90H87ClFN21O7S
• Molecular Weight: 1661.34 g/mol
• Exact Mass: 1659.65
• IUPAC Name: 5-(6-amino-3-pyridinyl)-N-(3-fluoro-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;2-chloro-4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one
• SMILES: CC(C)N1CCN(c2ccc(Nc3ccc(-c4cc[nH]c(=O)c4)n4ccnc34)cc2)CC1.CS(=O)(=O)c1ccc(Nc2ccc(-c3ccc(C(N)=O)c(Cl)c3)n3ccnc23)cc1.Nc1ccc(-c2ccc(Nc3ccc(N4CCOCC4)c(F)c3)c3nccn23)cn1.O=c1cc(-c2ccc(Nc3ccc(N4CCOCC4)cc3)c3nccn23)cc[nH]1
• InChI: InChI=1S/C25H28N6O.C22H21FN6O.C22H21N5O2.C21H17ClN4O3S/c1-18(2)29-13-15-30(16-14-29)21-5-3-20(4-6-21)28-22-7-8-23(31-12-11-27-25(22)31)19-9-10-26-24(32)17-19;23-17-13-16(2-4-20(17)28-9-11-30-12-10-28)27-18-3-5-19(29-8-7-25-22(18)29)15-1-6-21(24)26-14-15;28-21-15-16(7-8-23-21)20-6-5-19(22-24-9-10-27(20)22)25-17-1-3-18(4-2-17)26-11-13-29-14-12-26;1-30(28,29)15-5-3-14(4-6-15)25-18-8-9-19(26-11-10-24-21(18)26)13-2-7-16(20(23)27)17(22)12-13/h3-12,17-18,28H,13-16H2,1-2H3,(H,26,32);1-8,13-14,27H,9-12H2,(H2,24,26);1-10,15,25H,11-14H2,(H,23,28);2-12,25H,1H3,(H2,23,27)
• InChIKey: BKOHASFZHHUTMM-UHFFFAOYSA-N
• XLogP: 14.83
• TPSA: 330.60 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 25
• Rotatable Bonds: 18
• Heavy Atoms: 121
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1661.34
LogP ≤ 5	14.83
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-(6-amino-3-pyridinyl)-N-(3-fluoro-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;2-chloro-4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one?

The IUPAC name of 5-(6-amino-3-pyridinyl)-N-(3-fluoro-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;2-chloro-4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one (CID 157378188) is 5-(6-amino-3-pyridinyl)-N-(3-fluoro-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;2-chloro-4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one.

What is the SMILES notation for 5-(6-amino-3-pyridinyl)-N-(3-fluoro-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;2-chloro-4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one?

The canonical SMILES for 5-(6-amino-3-pyridinyl)-N-(3-fluoro-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;2-chloro-4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one is CC(C)N1CCN(c2ccc(Nc3ccc(-c4cc[nH]c(=O)c4)n4ccnc34)cc2)CC1.CS(=O)(=O)c1ccc(Nc2ccc(-c3ccc(C(N)=O)c(Cl)c3)n3ccnc23)cc1.Nc1ccc(-c2ccc(Nc3ccc(N4CCOCC4)c(F)c3)c3nccn23)cn1.O=c1cc(-c2ccc(Nc3ccc(N4CCOCC4)cc3)c3nccn23)cc[nH]1.

What is the InChIKey of 5-(6-amino-3-pyridinyl)-N-(3-fluoro-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;2-chloro-4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one?

The InChIKey is BKOHASFZHHUTMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N6O.C22H21FN6O.C22H21N5O2.C21H17ClN4O3S/c1-18(2)29-13-15-30(16-14-29)21-5-3-20(4-6-21)28-22-7-8-23(31-12-11-27-25(22)31)19-9-10-26-24(32)17-19;23-17-13-16(2-4-20(17)28-9-11-30-12-10-28)27-18-3-5-19(29-8-7-25-22(18)29)15-1-6-21(24)26-14-15;28-21-15-16(7-8-23-21)20-6-5-19(22-24-9-10-27(20)22)25-17-1-3-18(4-2-17)26-11-13-29-14-12-26;1-30(28,29)15-5-3-14(4-6-15)25-18-8-9-19(26-11-10-24-21(18)26)13-2-7-16(20(23)27)17(22)12-13/h3-12,17-18,28H,13-16H2,1-2H3,(H,26,32);1-8,13-14,27H,9-12H2,(H2,24,26);1-10,15,25H,11-14H2,(H,23,28);2-12,25H,1H3,(H2,23,27).

What are the key properties of 5-(6-amino-3-pyridinyl)-N-(3-fluoro-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;2-chloro-4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one?

5-(6-amino-3-pyridinyl)-N-(3-fluoro-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;2-chloro-4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one has a molecular weight of 1661.34 g/mol, XLogP of 14.83, 18 rotatable bonds, 8 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(6-amino-3-pyridinyl)-N-(3-fluoro-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-8-amine;2-chloro-4-[8-(4-methylsulfonylanilino)imidazo[1,2-a]pyridin-5-yl]benzamide;4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one;4-[8-[4-(4-propan-2-ylpiperazin-1-yl)anilino]imidazo[1,2-a]pyridin-5-yl]-1H-pyridin-2-one is sourced from PubChem (CID 157378188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).