N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide

C122H98N36O6S12 — CID 158357949

IUPACN-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide
SMILESCNC(=O)c1ccc(Nc2nc(-c3cnc4ccccn34)c(C)s2)s1.CNC(=O)c1ccc(Nc2nc(-c3cnc4ccccn34)cs2)s1.Cc1sc(Nc2ccc(C(=O)Nc3ccccc3N)s2)nc1-c1cnc2ccccn12.Cc1sc(Nc2ccc(C(=O)Nc3nn(-c4ccccc4)cc3N)s2)nc1-c1cnc2ccccn12.Nc1ccccc1NC(=O)c1ccc(Nc2nc(-c3cnc4ccccn34)cs2)s1.Nc1ccccc1NC(=O)c1ccc(Nc2nc(-c3cnc4ccccn34)cs2)s1
InChIInChI=1S/C25H20N8OS2.C22H18N6OS2.2C21H16N6OS2.C17H15N5OS2.C16H13N5OS2/c1-15-22(18-13-27-20-9-5-6-12-32(18)20)29-25(35-15)28-21-11-10-19(36-21)24(34)30-23-17(26)14-33(31-23)16-7-3-2-4-8-16;1-13-20(16-12-24-18-8-4-5-11-28(16)18)27-22(30-13)26-19-10-9-17(31-19)21(29)25-15-7-3-2-6-14(15)23;2*22-13-5-1-2-6-14(13)24-20(28)17-8-9-19(30-17)26-21-25-15(12-29-21)16-11-23-18-7-3-4-10-27(16)18;1-10-15(11-9-19-13-5-3-4-8-22(11)13)21-17(24-10)20-14-7-6-12(25-14)16(23)18-2;1-17-15(22)12-5-6-14(24-12)20-16-19-10(9-23-16)11-8-18-13-4-2-3-7-21(11)13/h2-14H,26H2,1H3,(H,28,29)(H,30,31,34);2-12H,23H2,1H3,(H,25,29)(H,26,27);2*1-12H,22H2,(H,24,28)(H,25,26);3-9H,1-2H3,(H,18,23)(H,20,21);2-9H,1H3,(H,17,22)(H,19,20)
InChIKeyGTCNKZKSCHBMLM-UHFFFAOYSA-N
MW2549.18 g/mol
LogP28.75
Rot. Bonds29

About N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide

N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide (PubChem CID 158357949) has the molecular formula C122H98N36O6S12 and a molecular weight of 2549.18 g/mol. Its IUPAC name is N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide
PubChem CID158357949
Molecular FormulaC122H98N36O6S12
Molecular Weight2549.18 g/mol
Exact Mass2546.51
IUPAC NameN-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide
SMILESCNC(=O)c1ccc(Nc2nc(-c3cnc4ccccn34)c(C)s2)s1.CNC(=O)c1ccc(Nc2nc(-c3cnc4ccccn34)cs2)s1.Cc1sc(Nc2ccc(C(=O)Nc3ccccc3N)s2)nc1-c1cnc2ccccn12.Cc1sc(Nc2ccc(C(=O)Nc3nn(-c4ccccc4)cc3N)s2)nc1-c1cnc2ccccn12.Nc1ccccc1NC(=O)c1ccc(Nc2nc(-c3cnc4ccccn34)cs2)s1.Nc1ccccc1NC(=O)c1ccc(Nc2nc(-c3cnc4ccccn34)cs2)s1
InChIInChI=1S/C25H20N8OS2.C22H18N6OS2.2C21H16N6OS2.C17H15N5OS2.C16H13N5OS2/c1-15-22(18-13-27-20-9-5-6-12-32(18)20)29-25(35-15)28-21-11-10-19(36-21)24(34)30-23-17(26)14-33(31-23)16-7-3-2-4-8-16;1-13-20(16-12-24-18-8-4-5-11-28(16)18)27-22(30-13)26-19-10-9-17(31-19)21(29)25-15-7-3-2-6-14(15)23;2*22-13-5-1-2-6-14(13)24-20(28)17-8-9-19(30-17)26-21-25-15(12-29-21)16-11-23-18-7-3-4-10-27(16)18;1-10-15(11-9-19-13-5-3-4-8-22(11)13)21-17(24-10)20-14-7-6-12(25-14)16(23)18-2;1-17-15(22)12-5-6-14(24-12)20-16-19-10(9-23-16)11-8-18-13-4-2-3-7-21(11)13/h2-14H,26H2,1H3,(H,28,29)(H,30,31,34);2-12H,23H2,1H3,(H,25,29)(H,26,27);2*1-12H,22H2,(H,24,28)(H,25,26);3-9H,1-2H3,(H,18,23)(H,20,21);2-9H,1H3,(H,17,22)(H,19,20)
InChIKeyGTCNKZKSCHBMLM-UHFFFAOYSA-N
XLogP28.75
TPSA549.82 Ų
H-Bond Donors16
H-Bond Acceptors48
Rotatable Bonds29
Heavy Atoms176
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002549.18
LogP ≤ 528.75
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1048

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide?
The IUPAC name of N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide (CID 158357949) is N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide.
What is the SMILES notation for N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide?
The canonical SMILES for N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide is CNC(=O)c1ccc(Nc2nc(-c3cnc4ccccn34)c(C)s2)s1.CNC(=O)c1ccc(Nc2nc(-c3cnc4ccccn34)cs2)s1.Cc1sc(Nc2ccc(C(=O)Nc3ccccc3N)s2)nc1-c1cnc2ccccn12.Cc1sc(Nc2ccc(C(=O)Nc3nn(-c4ccccc4)cc3N)s2)nc1-c1cnc2ccccn12.Nc1ccccc1NC(=O)c1ccc(Nc2nc(-c3cnc4ccccn34)cs2)s1.Nc1ccccc1NC(=O)c1ccc(Nc2nc(-c3cnc4ccccn34)cs2)s1.
What is the InChIKey of N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide?
The InChIKey is GTCNKZKSCHBMLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N8OS2.C22H18N6OS2.2C21H16N6OS2.C17H15N5OS2.C16H13N5OS2/c1-15-22(18-13-27-20-9-5-6-12-32(18)20)29-25(35-15)28-21-11-10-19(36-21)24(34)30-23-17(26)14-33(31-23)16-7-3-2-4-8-16;1-13-20(16-12-24-18-8-4-5-11-28(16)18)27-22(30-13)26-19-10-9-17(31-19)21(29)25-15-7-3-2-6-14(15)23;2*22-13-5-1-2-6-14(13)24-20(28)17-8-9-19(30-17)26-21-25-15(12-29-21)16-11-23-18-7-3-4-10-27(16)18;1-10-15(11-9-19-13-5-3-4-8-22(11)13)21-17(24-10)20-14-7-6-12(25-14)16(23)18-2;1-17-15(22)12-5-6-14(24-12)20-16-19-10(9-23-16)11-8-18-13-4-2-3-7-21(11)13/h2-14H,26H2,1H3,(H,28,29)(H,30,31,34);2-12H,23H2,1H3,(H,25,29)(H,26,27);2*1-12H,22H2,(H,24,28)(H,25,26);3-9H,1-2H3,(H,18,23)(H,20,21);2-9H,1H3,(H,17,22)(H,19,20).
What are the key properties of N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide?
N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide has a molecular weight of 2549.18 g/mol, XLogP of 28.75, 29 rotatable bonds, 16 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;bis(N-(2-aminophenyl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide);N-(4-amino-1-phenylpyrazol-3-yl)-5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]thiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-5-methyl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide;5-[(4-imidazo[1,2-a]pyridin-3-yl-1,3-thiazol-2-yl)amino]-N-methylthiophene-2-carboxamide is sourced from PubChem (CID 158357949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).