lithium;N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;benzene-1,2-diamine;(E)-3-(dimethylamino)-1-imidazo[1,2-a]pyridin-3-ylprop-2-en-1-one;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;imidazo[1,2-a]pyridine;1-imidazo[1,2-a]pyridin-3-ylethanone;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid;methyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;hydroxide

C113H97LiN32O10 — CID 158212134

About lithium;N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;benzene-1,2-diamine;(E)-3-(dimethylamino)-1-imidazo[1,2-a]pyridin-3-ylprop-2-en-1-one;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;imidazo[1,2-a]pyridine;1-imidazo[1,2-a]pyridin-3-ylethanone;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid;methyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;hydroxide

lithium;N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;benzene-1,2-diamine;(E)-3-(dimethylamino)-1-imidazo[1,2-a]pyridin-3-ylprop-2-en-1-one;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;imidazo[1,2-a]pyridine;1-imidazo[1,2-a]pyridin-3-ylethanone;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid;methyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;hydroxide (PubChem CID 158212134) has the molecular formula C113H97LiN32O10 and a molecular weight of 2070.17 g/mol. Its IUPAC name is lithium;N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;benzene-1,2-diamine;(E)-3-(dimethylamino)-1-imidazo[1,2-a]pyridin-3-ylprop-2-en-1-one;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;imidazo[1,2-a]pyridine;1-imidazo[1,2-a]pyridin-3-ylethanone;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid;methyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;hydroxide.

Molecular Properties

• Compound Name: lithium;N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;benzene-1,2-diamine;(E)-3-(dimethylamino)-1-imidazo[1,2-a]pyridin-3-ylprop-2-en-1-one;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;imidazo[1,2-a]pyridine;1-imidazo[1,2-a]pyridin-3-ylethanone;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid;methyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;hydroxide
• PubChem CID: 158212134
• Molecular Formula: C113H97LiN32O10
• Molecular Weight: 2070.17 g/mol
• Exact Mass: 2068.82
• IUPAC Name: lithium;N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;benzene-1,2-diamine;(E)-3-(dimethylamino)-1-imidazo[1,2-a]pyridin-3-ylprop-2-en-1-one;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;imidazo[1,2-a]pyridine;1-imidazo[1,2-a]pyridin-3-ylethanone;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid;methyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;hydroxide
• SMILES: CC(=O)c1cnc2ccccn12.CN(C)/C=C/C(=O)c1cnc2ccccn12.COC(=O)c1ccc(Nc2nccc(-c3cnc4ccccn34)n2)cc1.Nc1ccccc1N.Nc1ccccc1NC(=O)c1ccc(Nc2nccc(-c3cnc4ccccn34)n2)cc1.O=C(NO)c1ccc(Nc2nccc(-c3cnc4ccccn34)n2)cc1.O=C(O)c1ccc(Nc2nccc(-c3cnc4ccccn34)n2)cc1.[Li+].[OH-].c1ccn2ccnc2c1
• InChI: InChI=1S/C24H19N7O.C19H15N5O2.C18H14N6O2.C18H13N5O2.C12H13N3O.C9H8N2O.C7H6N2.C6H8N2.Li.H2O/c25-18-5-1-2-6-19(18)29-23(32)16-8-10-17(11-9-16)28-24-26-13-12-20(30-24)21-15-27-22-7-3-4-14-31(21)22;1-26-18(25)13-5-7-14(8-6-13)22-19-20-10-9-15(23-19)16-12-21-17-4-2-3-11-24(16)17;25-17(23-26)12-4-6-13(7-5-12)21-18-19-9-8-14(22-18)15-11-20-16-3-1-2-10-24(15)16;24-17(25)12-4-6-13(7-5-12)21-18-19-9-8-14(22-18)15-11-20-16-3-1-2-10-23(15)16;1-14(2)8-6-11(16)10-9-13-12-5-3-4-7-15(10)12;1-7(12)8-6-10-9-4-2-3-5-11(8)9;1-2-5-9-6-4-8-7(9)3-1;7-5-3-1-2-4-6(5)8;;/h1-15H,25H2,(H,29,32)(H,26,28,30);2-12H,1H3,(H,20,22,23);1-11,26H,(H,23,25)(H,19,21,22);1-11H,(H,24,25)(H,19,21,22);3-9H,1-2H3;2-6H,1H3;1-6H;1-4H,7-8H2;;1H2/q;;;;;;;;+1;/p-1/b;;;;8-6+
• InChIKey: GCFAXTYVQXBONV-FLEDTRFTSA-M
• XLogP: 15.72
• TPSA: 559.81 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 39
• Rotatable Bonds: 21
• Heavy Atoms: 156
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2070.17
LogP ≤ 5	15.72
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	39

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of lithium;N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;benzene-1,2-diamine;(E)-3-(dimethylamino)-1-imidazo[1,2-a]pyridin-3-ylprop-2-en-1-one;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;imidazo[1,2-a]pyridine;1-imidazo[1,2-a]pyridin-3-ylethanone;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid;methyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;hydroxide?

The IUPAC name of lithium;N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;benzene-1,2-diamine;(E)-3-(dimethylamino)-1-imidazo[1,2-a]pyridin-3-ylprop-2-en-1-one;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;imidazo[1,2-a]pyridine;1-imidazo[1,2-a]pyridin-3-ylethanone;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid;methyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;hydroxide (CID 158212134) is lithium;N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;benzene-1,2-diamine;(E)-3-(dimethylamino)-1-imidazo[1,2-a]pyridin-3-ylprop-2-en-1-one;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;imidazo[1,2-a]pyridine;1-imidazo[1,2-a]pyridin-3-ylethanone;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid;methyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;hydroxide.

What is the SMILES notation for lithium;N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;benzene-1,2-diamine;(E)-3-(dimethylamino)-1-imidazo[1,2-a]pyridin-3-ylprop-2-en-1-one;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;imidazo[1,2-a]pyridine;1-imidazo[1,2-a]pyridin-3-ylethanone;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid;methyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;hydroxide?

The canonical SMILES for lithium;N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;benzene-1,2-diamine;(E)-3-(dimethylamino)-1-imidazo[1,2-a]pyridin-3-ylprop-2-en-1-one;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;imidazo[1,2-a]pyridine;1-imidazo[1,2-a]pyridin-3-ylethanone;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid;methyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;hydroxide is CC(=O)c1cnc2ccccn12.CN(C)/C=C/C(=O)c1cnc2ccccn12.COC(=O)c1ccc(Nc2nccc(-c3cnc4ccccn34)n2)cc1.Nc1ccccc1N.Nc1ccccc1NC(=O)c1ccc(Nc2nccc(-c3cnc4ccccn34)n2)cc1.O=C(NO)c1ccc(Nc2nccc(-c3cnc4ccccn34)n2)cc1.O=C(O)c1ccc(Nc2nccc(-c3cnc4ccccn34)n2)cc1.[Li+].[OH-].c1ccn2ccnc2c1.

What is the InChIKey of lithium;N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;benzene-1,2-diamine;(E)-3-(dimethylamino)-1-imidazo[1,2-a]pyridin-3-ylprop-2-en-1-one;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;imidazo[1,2-a]pyridine;1-imidazo[1,2-a]pyridin-3-ylethanone;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid;methyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;hydroxide?

The InChIKey is GCFAXTYVQXBONV-FLEDTRFTSA-M. The full InChI is InChI=1S/C24H19N7O.C19H15N5O2.C18H14N6O2.C18H13N5O2.C12H13N3O.C9H8N2O.C7H6N2.C6H8N2.Li.H2O/c25-18-5-1-2-6-19(18)29-23(32)16-8-10-17(11-9-16)28-24-26-13-12-20(30-24)21-15-27-22-7-3-4-14-31(21)22;1-26-18(25)13-5-7-14(8-6-13)22-19-20-10-9-15(23-19)16-12-21-17-4-2-3-11-24(16)17;25-17(23-26)12-4-6-13(7-5-12)21-18-19-9-8-14(22-18)15-11-20-16-3-1-2-10-24(15)16;24-17(25)12-4-6-13(7-5-12)21-18-19-9-8-14(22-18)15-11-20-16-3-1-2-10-23(15)16;1-14(2)8-6-11(16)10-9-13-12-5-3-4-7-15(10)12;1-7(12)8-6-10-9-4-2-3-5-11(8)9;1-2-5-9-6-4-8-7(9)3-1;7-5-3-1-2-4-6(5)8;;/h1-15H,25H2,(H,29,32)(H,26,28,30);2-12H,1H3,(H,20,22,23);1-11,26H,(H,23,25)(H,19,21,22);1-11H,(H,24,25)(H,19,21,22);3-9H,1-2H3;2-6H,1H3;1-6H;1-4H,7-8H2;;1H2/q;;;;;;;;+1;/p-1/b;;;;8-6+;;;;;.

What are the key properties of lithium;N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;benzene-1,2-diamine;(E)-3-(dimethylamino)-1-imidazo[1,2-a]pyridin-3-ylprop-2-en-1-one;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;imidazo[1,2-a]pyridine;1-imidazo[1,2-a]pyridin-3-ylethanone;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid;methyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;hydroxide?

lithium;N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;benzene-1,2-diamine;(E)-3-(dimethylamino)-1-imidazo[1,2-a]pyridin-3-ylprop-2-en-1-one;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;imidazo[1,2-a]pyridine;1-imidazo[1,2-a]pyridin-3-ylethanone;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid;methyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;hydroxide has a molecular weight of 2070.17 g/mol, XLogP of 15.72, 21 rotatable bonds, 11 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for lithium;N-(2-aminophenyl)-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;benzene-1,2-diamine;(E)-3-(dimethylamino)-1-imidazo[1,2-a]pyridin-3-ylprop-2-en-1-one;N-hydroxy-4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzamide;imidazo[1,2-a]pyridine;1-imidazo[1,2-a]pyridin-3-ylethanone;4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid;methyl 4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]benzoate;hydroxide is sourced from PubChem (CID 158212134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).