3,4-dimethoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide

C111H98N16O9S8 — CID 159926573

About 3,4-dimethoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide

3,4-dimethoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide (PubChem CID 159926573) has the molecular formula C111H98N16O9S8 and a molecular weight of 2056.64 g/mol. Its IUPAC name is 3,4-dimethoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide.

Molecular Properties

• Compound Name: 3,4-dimethoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide
• PubChem CID: 159926573
• Molecular Formula: C111H98N16O9S8
• Molecular Weight: 2056.64 g/mol
• Exact Mass: 2054.55
• IUPAC Name: 3,4-dimethoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide
• SMILES: COc1ccc(C(=O)Nc2nc(-c3ccccc3)cs2)cc1OC.Cc1ccc(-c2csc(NC(=O)c3cccs3)n2)c(C)c1.O=C(Nc1nc(-c2ccccc2)cs1)C1CCCC1.O=C(Nc1nc(-c2ccccc2)cs1)C1CCCCC1.O=C(Nc1nc(-c2ccccc2)cs1)c1ccccc1.O=C(Nc1nc(-c2ccccc2)cs1)c1cccnc1.O=C(Nc1nc(-c2ccccc2)cs1)c1ccncc1
• InChI: InChI=1S/C18H16N2O3S.C16H14N2OS2.C16H18N2OS.C16H12N2OS.2C15H11N3OS.C15H16N2OS/c1-22-15-9-8-13(10-16(15)23-2)17(21)20-18-19-14(11-24-18)12-6-4-3-5-7-12;1-10-5-6-12(11(2)8-10)13-9-21-16(17-13)18-15(19)14-4-3-7-20-14;2*19-15(13-9-5-2-6-10-13)18-16-17-14(11-20-16)12-7-3-1-4-8-12;19-14(12-7-4-8-16-9-12)18-15-17-13(10-20-15)11-5-2-1-3-6-11;19-14(12-6-8-16-9-7-12)18-15-17-13(10-20-15)11-4-2-1-3-5-11;18-14(12-8-4-5-9-12)17-15-16-13(10-19-15)11-6-2-1-3-7-11/h3-11H,1-2H3,(H,19,20,21);3-9H,1-2H3,(H,17,18,19);1,3-4,7-8,11,13H,2,5-6,9-10H2,(H,17,18,19);1-11H,(H,17,18,19);2*1-10H,(H,17,18,19);1-3,6-7,10,12H,4-5,8-9H2,(H,16,17,18)
• InChIKey: NZBXRKBWLGXAFB-UHFFFAOYSA-N
• XLogP: 28.07
• TPSA: 338.17 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 26
• Rotatable Bonds: 23
• Heavy Atoms: 144
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2056.64
LogP ≤ 5	28.07
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide?

The IUPAC name of 3,4-dimethoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide (CID 159926573) is 3,4-dimethoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide.

What is the SMILES notation for 3,4-dimethoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide?

The canonical SMILES for 3,4-dimethoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide is COc1ccc(C(=O)Nc2nc(-c3ccccc3)cs2)cc1OC.Cc1ccc(-c2csc(NC(=O)c3cccs3)n2)c(C)c1.O=C(Nc1nc(-c2ccccc2)cs1)C1CCCC1.O=C(Nc1nc(-c2ccccc2)cs1)C1CCCCC1.O=C(Nc1nc(-c2ccccc2)cs1)c1ccccc1.O=C(Nc1nc(-c2ccccc2)cs1)c1cccnc1.O=C(Nc1nc(-c2ccccc2)cs1)c1ccncc1.

What is the InChIKey of 3,4-dimethoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide?

The InChIKey is NZBXRKBWLGXAFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O3S.C16H14N2OS2.C16H18N2OS.C16H12N2OS.2C15H11N3OS.C15H16N2OS/c1-22-15-9-8-13(10-16(15)23-2)17(21)20-18-19-14(11-24-18)12-6-4-3-5-7-12;1-10-5-6-12(11(2)8-10)13-9-21-16(17-13)18-15(19)14-4-3-7-20-14;2*19-15(13-9-5-2-6-10-13)18-16-17-14(11-20-16)12-7-3-1-4-8-12;19-14(12-7-4-8-16-9-12)18-15-17-13(10-20-15)11-5-2-1-3-6-11;19-14(12-6-8-16-9-7-12)18-15-17-13(10-20-15)11-4-2-1-3-5-11;18-14(12-8-4-5-9-12)17-15-16-13(10-19-15)11-6-2-1-3-7-11/h3-11H,1-2H3,(H,19,20,21);3-9H,1-2H3,(H,17,18,19);1,3-4,7-8,11,13H,2,5-6,9-10H2,(H,17,18,19);1-11H,(H,17,18,19);2*1-10H,(H,17,18,19);1-3,6-7,10,12H,4-5,8-9H2,(H,16,17,18).

What are the key properties of 3,4-dimethoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide?

3,4-dimethoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide has a molecular weight of 2056.64 g/mol, XLogP of 28.07, 23 rotatable bonds, 7 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 3,4-dimethoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)benzamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclohexanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide;N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide is sourced from PubChem (CID 159926573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).