N-(2-aminophenyl)-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;benzene-1,2-diamine;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;methyl 2-bromo-1,3-thiazole-4-carboxylate;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-thiazole-4-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylic acid;methyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylate;O-(oxan-2-yl)hydroxylamine

C120H112BrN43O14S6 — CID 160824138

About N-(2-aminophenyl)-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;benzene-1,2-diamine;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;methyl 2-bromo-1,3-thiazole-4-carboxylate;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-thiazole-4-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylic acid;methyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylate;O-(oxan-2-yl)hydroxylamine

N-(2-aminophenyl)-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;benzene-1,2-diamine;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;methyl 2-bromo-1,3-thiazole-4-carboxylate;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-thiazole-4-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylic acid;methyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylate;O-(oxan-2-yl)hydroxylamine (PubChem CID 160824138) has the molecular formula C120H112BrN43O14S6 and a molecular weight of 2652.81 g/mol. Its IUPAC name is N-(2-aminophenyl)-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;benzene-1,2-diamine;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;methyl 2-bromo-1,3-thiazole-4-carboxylate;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-thiazole-4-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylic acid;methyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylate;O-(oxan-2-yl)hydroxylamine.

Molecular Properties

• Compound Name: N-(2-aminophenyl)-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;benzene-1,2-diamine;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;methyl 2-bromo-1,3-thiazole-4-carboxylate;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-thiazole-4-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylic acid;methyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylate;O-(oxan-2-yl)hydroxylamine
• PubChem CID: 160824138
• Molecular Formula: C120H112BrN43O14S6
• Molecular Weight: 2652.81 g/mol
• Exact Mass: 2649.69
• IUPAC Name: N-(2-aminophenyl)-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;benzene-1,2-diamine;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;methyl 2-bromo-1,3-thiazole-4-carboxylate;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-thiazole-4-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylic acid;methyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylate;O-(oxan-2-yl)hydroxylamine
• SMILES: COC(=O)c1csc(Br)n1.COC(=O)c1csc(Nc2nccc(-c3c(C)nc4ccccn34)n2)n1.Cc1nc2ccccn2c1-c1ccnc(N)n1.Cc1nc2ccccn2c1-c1ccnc(Nc2nc(C(=O)NO)cs2)n1.Cc1nc2ccccn2c1-c1ccnc(Nc2nc(C(=O)NOC3CCCCO3)cs2)n1.Cc1nc2ccccn2c1-c1ccnc(Nc2nc(C(=O)Nc3ccccc3N)cs2)n1.Cc1nc2ccccn2c1-c1ccnc(Nc2nc(C(=O)O)cs2)n1.NOC1CCCCO1.Nc1ccccc1N
• InChI: InChI=1S/C22H18N8OS.C21H21N7O3S.C17H14N6O2S.C16H13N7O2S.C16H12N6O2S.C12H11N5.C6H8N2.C5H4BrNO2S.C5H11NO2/c1-13-19(30-11-5-4-8-18(30)25-13)16-9-10-24-21(27-16)29-22-28-17(12-32-22)20(31)26-15-7-3-2-6-14(15)23;1-13-18(28-10-4-2-6-16(28)23-13)14-8-9-22-20(24-14)26-21-25-15(12-32-21)19(29)27-31-17-7-3-5-11-30-17;1-10-14(23-8-4-3-5-13(23)19-10)11-6-7-18-16(20-11)22-17-21-12(9-26-17)15(24)25-2;1-9-13(23-7-3-2-4-12(23)18-9)10-5-6-17-15(19-10)21-16-20-11(8-26-16)14(24)22-25;1-9-13(22-7-3-2-4-12(22)18-9)10-5-6-17-15(19-10)21-16-20-11(8-25-16)14(23)24;1-8-11(9-5-6-14-12(13)16-9)17-7-3-2-4-10(17)15-8;7-5-3-1-2-4-6(5)8;1-9-4(8)3-2-10-5(6)7-3;6-8-5-3-1-2-4-7-5/h2-12H,23H2,1H3,(H,26,31)(H,24,27,28,29);2,4,6,8-10,12,17H,3,5,7,11H2,1H3,(H,27,29)(H,22,24,25,26);3-9H,1-2H3,(H,18,20,21,22);2-8,25H,1H3,(H,22,24)(H,17,19,20,21);2-8H,1H3,(H,23,24)(H,17,19,20,21);2-7H,1H3,(H2,13,14,16);1-4H,7-8H2;2H,1H3;5H,1-4,6H2
• InChIKey: SFYAMAHLQNREQC-UHFFFAOYSA-N
• XLogP: 20.75
• TPSA: 760.42 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 59
• Rotatable Bonds: 26
• Heavy Atoms: 184
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2652.81
LogP ≤ 5	20.75
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	59

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;benzene-1,2-diamine;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;methyl 2-bromo-1,3-thiazole-4-carboxylate;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-thiazole-4-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylic acid;methyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylate;O-(oxan-2-yl)hydroxylamine?

The IUPAC name of N-(2-aminophenyl)-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;benzene-1,2-diamine;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;methyl 2-bromo-1,3-thiazole-4-carboxylate;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-thiazole-4-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylic acid;methyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylate;O-(oxan-2-yl)hydroxylamine (CID 160824138) is N-(2-aminophenyl)-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;benzene-1,2-diamine;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;methyl 2-bromo-1,3-thiazole-4-carboxylate;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-thiazole-4-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylic acid;methyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylate;O-(oxan-2-yl)hydroxylamine.

What is the SMILES notation for N-(2-aminophenyl)-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;benzene-1,2-diamine;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;methyl 2-bromo-1,3-thiazole-4-carboxylate;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-thiazole-4-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylic acid;methyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylate;O-(oxan-2-yl)hydroxylamine?

The canonical SMILES for N-(2-aminophenyl)-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;benzene-1,2-diamine;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;methyl 2-bromo-1,3-thiazole-4-carboxylate;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-thiazole-4-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylic acid;methyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylate;O-(oxan-2-yl)hydroxylamine is COC(=O)c1csc(Br)n1.COC(=O)c1csc(Nc2nccc(-c3c(C)nc4ccccn34)n2)n1.Cc1nc2ccccn2c1-c1ccnc(N)n1.Cc1nc2ccccn2c1-c1ccnc(Nc2nc(C(=O)NO)cs2)n1.Cc1nc2ccccn2c1-c1ccnc(Nc2nc(C(=O)NOC3CCCCO3)cs2)n1.Cc1nc2ccccn2c1-c1ccnc(Nc2nc(C(=O)Nc3ccccc3N)cs2)n1.Cc1nc2ccccn2c1-c1ccnc(Nc2nc(C(=O)O)cs2)n1.NOC1CCCCO1.Nc1ccccc1N.

What is the InChIKey of N-(2-aminophenyl)-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;benzene-1,2-diamine;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;methyl 2-bromo-1,3-thiazole-4-carboxylate;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-thiazole-4-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylic acid;methyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylate;O-(oxan-2-yl)hydroxylamine?

The InChIKey is SFYAMAHLQNREQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N8OS.C21H21N7O3S.C17H14N6O2S.C16H13N7O2S.C16H12N6O2S.C12H11N5.C6H8N2.C5H4BrNO2S.C5H11NO2/c1-13-19(30-11-5-4-8-18(30)25-13)16-9-10-24-21(27-16)29-22-28-17(12-32-22)20(31)26-15-7-3-2-6-14(15)23;1-13-18(28-10-4-2-6-16(28)23-13)14-8-9-22-20(24-14)26-21-25-15(12-32-21)19(29)27-31-17-7-3-5-11-30-17;1-10-14(23-8-4-3-5-13(23)19-10)11-6-7-18-16(20-11)22-17-21-12(9-26-17)15(24)25-2;1-9-13(23-7-3-2-4-12(23)18-9)10-5-6-17-15(19-10)21-16-20-11(8-26-16)14(24)22-25;1-9-13(22-7-3-2-4-12(22)18-9)10-5-6-17-15(19-10)21-16-20-11(8-25-16)14(23)24;1-8-11(9-5-6-14-12(13)16-9)17-7-3-2-4-10(17)15-8;7-5-3-1-2-4-6(5)8;1-9-4(8)3-2-10-5(6)7-3;6-8-5-3-1-2-4-7-5/h2-12H,23H2,1H3,(H,26,31)(H,24,27,28,29);2,4,6,8-10,12,17H,3,5,7,11H2,1H3,(H,27,29)(H,22,24,25,26);3-9H,1-2H3,(H,18,20,21,22);2-8,25H,1H3,(H,22,24)(H,17,19,20,21);2-8H,1H3,(H,23,24)(H,17,19,20,21);2-7H,1H3,(H2,13,14,16);1-4H,7-8H2;2H,1H3;5H,1-4,6H2.

What are the key properties of N-(2-aminophenyl)-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;benzene-1,2-diamine;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;methyl 2-bromo-1,3-thiazole-4-carboxylate;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-thiazole-4-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylic acid;methyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylate;O-(oxan-2-yl)hydroxylamine?

N-(2-aminophenyl)-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;benzene-1,2-diamine;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;methyl 2-bromo-1,3-thiazole-4-carboxylate;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-thiazole-4-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylic acid;methyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylate;O-(oxan-2-yl)hydroxylamine has a molecular weight of 2652.81 g/mol, XLogP of 20.75, 26 rotatable bonds, 15 hydrogen bond donors, and 59 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-aminophenyl)-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;benzene-1,2-diamine;N-hydroxy-2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;methyl 2-bromo-1,3-thiazole-4-carboxylate;4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-N-(oxan-2-yloxy)-1,3-thiazole-4-carboxamide;2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylic acid;methyl 2-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxylate;O-(oxan-2-yl)hydroxylamine is sourced from PubChem (CID 160824138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).