5-(3-chloro-5-methylphenyl)-1,3-thiazole;2-iodo-1-methoxy-4-methylbenzene;2-(2-methoxy-5-methylphenyl)-1H-pyrrole;5-(2-methoxy-5-methylphenyl)-1,3-thiazole;3-(2-methoxy-5-methylphenyl)thiophene;6-methyl-1H-benzimidazol-2-amine;6-methyl-1,3-benzothiazol-2-amine;1-methyl-4-(3-methylphenyl)piperazine;4-methyl-3-(3-methylphenyl)-1,2,4-triazole;4-(3-methylphenyl)-1H-pyrazole;2-(3-methylphenyl)-1H-pyrrole;2-(3-methylphenyl)thiophene;3-(3-methylphenyl)thiophene;4-(3-methylphenyl)-2H-triazole;5-methyl-1H-pyridin-2-one;4-methyl-2-(1,3-thiazol-5-yl)phenol

C159H165ClIN21O6S7 — CID 162161676

About 5-(3-chloro-5-methylphenyl)-1,3-thiazole;2-iodo-1-methoxy-4-methylbenzene;2-(2-methoxy-5-methylphenyl)-1H-pyrrole;5-(2-methoxy-5-methylphenyl)-1,3-thiazole;3-(2-methoxy-5-methylphenyl)thiophene;6-methyl-1H-benzimidazol-2-amine;6-methyl-1,3-benzothiazol-2-amine;1-methyl-4-(3-methylphenyl)piperazine;4-methyl-3-(3-methylphenyl)-1,2,4-triazole;4-(3-methylphenyl)-1H-pyrazole;2-(3-methylphenyl)-1H-pyrrole;2-(3-methylphenyl)thiophene;3-(3-methylphenyl)thiophene;4-(3-methylphenyl)-2H-triazole;5-methyl-1H-pyridin-2-one;4-methyl-2-(1,3-thiazol-5-yl)phenol

5-(3-chloro-5-methylphenyl)-1,3-thiazole;2-iodo-1-methoxy-4-methylbenzene;2-(2-methoxy-5-methylphenyl)-1H-pyrrole;5-(2-methoxy-5-methylphenyl)-1,3-thiazole;3-(2-methoxy-5-methylphenyl)thiophene;6-methyl-1H-benzimidazol-2-amine;6-methyl-1,3-benzothiazol-2-amine;1-methyl-4-(3-methylphenyl)piperazine;4-methyl-3-(3-methylphenyl)-1,2,4-triazole;4-(3-methylphenyl)-1H-pyrazole;2-(3-methylphenyl)-1H-pyrrole;2-(3-methylphenyl)thiophene;3-(3-methylphenyl)thiophene;4-(3-methylphenyl)-2H-triazole;5-methyl-1H-pyridin-2-one;4-methyl-2-(1,3-thiazol-5-yl)phenol (PubChem CID 162161676) has the molecular formula C159H165ClIN21O6S7 and a molecular weight of 2853.04 g/mol. Its IUPAC name is 5-(3-chloro-5-methylphenyl)-1,3-thiazole;2-iodo-1-methoxy-4-methylbenzene;2-(2-methoxy-5-methylphenyl)-1H-pyrrole;5-(2-methoxy-5-methylphenyl)-1,3-thiazole;3-(2-methoxy-5-methylphenyl)thiophene;6-methyl-1H-benzimidazol-2-amine;6-methyl-1,3-benzothiazol-2-amine;1-methyl-4-(3-methylphenyl)piperazine;4-methyl-3-(3-methylphenyl)-1,2,4-triazole;4-(3-methylphenyl)-1H-pyrazole;2-(3-methylphenyl)-1H-pyrrole;2-(3-methylphenyl)thiophene;3-(3-methylphenyl)thiophene;4-(3-methylphenyl)-2H-triazole;5-methyl-1H-pyridin-2-one;4-methyl-2-(1,3-thiazol-5-yl)phenol.

Molecular Properties

• Compound Name: 5-(3-chloro-5-methylphenyl)-1,3-thiazole;2-iodo-1-methoxy-4-methylbenzene;2-(2-methoxy-5-methylphenyl)-1H-pyrrole;5-(2-methoxy-5-methylphenyl)-1,3-thiazole;3-(2-methoxy-5-methylphenyl)thiophene;6-methyl-1H-benzimidazol-2-amine;6-methyl-1,3-benzothiazol-2-amine;1-methyl-4-(3-methylphenyl)piperazine;4-methyl-3-(3-methylphenyl)-1,2,4-triazole;4-(3-methylphenyl)-1H-pyrazole;2-(3-methylphenyl)-1H-pyrrole;2-(3-methylphenyl)thiophene;3-(3-methylphenyl)thiophene;4-(3-methylphenyl)-2H-triazole;5-methyl-1H-pyridin-2-one;4-methyl-2-(1,3-thiazol-5-yl)phenol
• PubChem CID: 162161676
• Molecular Formula: C159H165ClIN21O6S7
• Molecular Weight: 2853.04 g/mol
• Exact Mass: 2850.00
• IUPAC Name: 5-(3-chloro-5-methylphenyl)-1,3-thiazole;2-iodo-1-methoxy-4-methylbenzene;2-(2-methoxy-5-methylphenyl)-1H-pyrrole;5-(2-methoxy-5-methylphenyl)-1,3-thiazole;3-(2-methoxy-5-methylphenyl)thiophene;6-methyl-1H-benzimidazol-2-amine;6-methyl-1,3-benzothiazol-2-amine;1-methyl-4-(3-methylphenyl)piperazine;4-methyl-3-(3-methylphenyl)-1,2,4-triazole;4-(3-methylphenyl)-1H-pyrazole;2-(3-methylphenyl)-1H-pyrrole;2-(3-methylphenyl)thiophene;3-(3-methylphenyl)thiophene;4-(3-methylphenyl)-2H-triazole;5-methyl-1H-pyridin-2-one;4-methyl-2-(1,3-thiazol-5-yl)phenol
• SMILES: COc1ccc(C)cc1-c1ccc[nH]1.COc1ccc(C)cc1-c1ccsc1.COc1ccc(C)cc1-c1cncs1.COc1ccc(C)cc1I.Cc1cc(Cl)cc(-c2cncs2)c1.Cc1ccc(=O)[nH]c1.Cc1ccc(O)c(-c2cncs2)c1.Cc1ccc2nc(N)[nH]c2c1.Cc1ccc2nc(N)sc2c1.Cc1cccc(-c2ccc[nH]2)c1.Cc1cccc(-c2cccs2)c1.Cc1cccc(-c2ccsc2)c1.Cc1cccc(-c2cn[nH]c2)c1.Cc1cccc(-c2cn[nH]n2)c1.Cc1cccc(-c2nncn2C)c1.Cc1cccc(N2CCN(C)CC2)c1
• InChI: InChI=1S/C12H18N2.C12H13NO.C12H12OS.C11H11NOS.C11H11N.2C11H10S.C10H8ClNS.C10H11N3.C10H10N2.C10H9NOS.C9H9N3.C8H9IO.C8H9N3.C8H8N2S.C6H7NO/c1-11-4-3-5-12(10-11)14-8-6-13(2)7-9-14;1-9-5-6-12(14-2)10(8-9)11-4-3-7-13-11;1-9-3-4-12(13-2)11(7-9)10-5-6-14-8-10;1-8-3-4-10(13-2)9(5-8)11-6-12-7-14-11;2*1-9-4-2-5-10(8-9)11-6-3-7-12-11;1-9-3-2-4-10(7-9)11-5-6-12-8-11;1-7-2-8(4-9(11)3-7)10-5-12-6-13-10;1-8-4-3-5-9(6-8)10-12-11-7-13(10)2;1-8-3-2-4-9(5-8)10-6-11-12-7-10;1-7-2-3-9(12)8(4-7)10-5-11-6-13-10;1-7-3-2-4-8(5-7)9-6-10-12-11-9;1-6-3-4-8(10-2)7(9)5-6;2*1-5-2-3-6-7(4-5)11-8(9)10-6;1-5-2-3-6(8)7-4-5/h3-5,10H,6-9H2,1-2H3;3-8,13H,1-2H3;3-8H,1-2H3;3-7H,1-2H3;2-8,12H,1H3;2*2-8H,1H3;2-6H,1H3;3-7H,1-2H3;2-7H,1H3,(H,11,12);2-6,12H,1H3;2-6H,1H3,(H,10,11,12);3-5H,1-2H3;2-4H,1H3,(H3,9,10,11);2-4H,1H3,(H2,9,10);2-4H,1H3,(H,7,8)
• InChIKey: ZMOJOILNFFOUQN-UHFFFAOYSA-N
• XLogP: 41.53
• TPSA: 361.31 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 28
• Rotatable Bonds: 16
• Heavy Atoms: 195
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2853.04
LogP ≤ 5	41.53
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-(3-chloro-5-methylphenyl)-1,3-thiazole;2-iodo-1-methoxy-4-methylbenzene;2-(2-methoxy-5-methylphenyl)-1H-pyrrole;5-(2-methoxy-5-methylphenyl)-1,3-thiazole;3-(2-methoxy-5-methylphenyl)thiophene;6-methyl-1H-benzimidazol-2-amine;6-methyl-1,3-benzothiazol-2-amine;1-methyl-4-(3-methylphenyl)piperazine;4-methyl-3-(3-methylphenyl)-1,2,4-triazole;4-(3-methylphenyl)-1H-pyrazole;2-(3-methylphenyl)-1H-pyrrole;2-(3-methylphenyl)thiophene;3-(3-methylphenyl)thiophene;4-(3-methylphenyl)-2H-triazole;5-methyl-1H-pyridin-2-one;4-methyl-2-(1,3-thiazol-5-yl)phenol?

The IUPAC name of 5-(3-chloro-5-methylphenyl)-1,3-thiazole;2-iodo-1-methoxy-4-methylbenzene;2-(2-methoxy-5-methylphenyl)-1H-pyrrole;5-(2-methoxy-5-methylphenyl)-1,3-thiazole;3-(2-methoxy-5-methylphenyl)thiophene;6-methyl-1H-benzimidazol-2-amine;6-methyl-1,3-benzothiazol-2-amine;1-methyl-4-(3-methylphenyl)piperazine;4-methyl-3-(3-methylphenyl)-1,2,4-triazole;4-(3-methylphenyl)-1H-pyrazole;2-(3-methylphenyl)-1H-pyrrole;2-(3-methylphenyl)thiophene;3-(3-methylphenyl)thiophene;4-(3-methylphenyl)-2H-triazole;5-methyl-1H-pyridin-2-one;4-methyl-2-(1,3-thiazol-5-yl)phenol (CID 162161676) is 5-(3-chloro-5-methylphenyl)-1,3-thiazole;2-iodo-1-methoxy-4-methylbenzene;2-(2-methoxy-5-methylphenyl)-1H-pyrrole;5-(2-methoxy-5-methylphenyl)-1,3-thiazole;3-(2-methoxy-5-methylphenyl)thiophene;6-methyl-1H-benzimidazol-2-amine;6-methyl-1,3-benzothiazol-2-amine;1-methyl-4-(3-methylphenyl)piperazine;4-methyl-3-(3-methylphenyl)-1,2,4-triazole;4-(3-methylphenyl)-1H-pyrazole;2-(3-methylphenyl)-1H-pyrrole;2-(3-methylphenyl)thiophene;3-(3-methylphenyl)thiophene;4-(3-methylphenyl)-2H-triazole;5-methyl-1H-pyridin-2-one;4-methyl-2-(1,3-thiazol-5-yl)phenol.

What is the SMILES notation for 5-(3-chloro-5-methylphenyl)-1,3-thiazole;2-iodo-1-methoxy-4-methylbenzene;2-(2-methoxy-5-methylphenyl)-1H-pyrrole;5-(2-methoxy-5-methylphenyl)-1,3-thiazole;3-(2-methoxy-5-methylphenyl)thiophene;6-methyl-1H-benzimidazol-2-amine;6-methyl-1,3-benzothiazol-2-amine;1-methyl-4-(3-methylphenyl)piperazine;4-methyl-3-(3-methylphenyl)-1,2,4-triazole;4-(3-methylphenyl)-1H-pyrazole;2-(3-methylphenyl)-1H-pyrrole;2-(3-methylphenyl)thiophene;3-(3-methylphenyl)thiophene;4-(3-methylphenyl)-2H-triazole;5-methyl-1H-pyridin-2-one;4-methyl-2-(1,3-thiazol-5-yl)phenol?

The canonical SMILES for 5-(3-chloro-5-methylphenyl)-1,3-thiazole;2-iodo-1-methoxy-4-methylbenzene;2-(2-methoxy-5-methylphenyl)-1H-pyrrole;5-(2-methoxy-5-methylphenyl)-1,3-thiazole;3-(2-methoxy-5-methylphenyl)thiophene;6-methyl-1H-benzimidazol-2-amine;6-methyl-1,3-benzothiazol-2-amine;1-methyl-4-(3-methylphenyl)piperazine;4-methyl-3-(3-methylphenyl)-1,2,4-triazole;4-(3-methylphenyl)-1H-pyrazole;2-(3-methylphenyl)-1H-pyrrole;2-(3-methylphenyl)thiophene;3-(3-methylphenyl)thiophene;4-(3-methylphenyl)-2H-triazole;5-methyl-1H-pyridin-2-one;4-methyl-2-(1,3-thiazol-5-yl)phenol is COc1ccc(C)cc1-c1ccc[nH]1.COc1ccc(C)cc1-c1ccsc1.COc1ccc(C)cc1-c1cncs1.COc1ccc(C)cc1I.Cc1cc(Cl)cc(-c2cncs2)c1.Cc1ccc(=O)[nH]c1.Cc1ccc(O)c(-c2cncs2)c1.Cc1ccc2nc(N)[nH]c2c1.Cc1ccc2nc(N)sc2c1.Cc1cccc(-c2ccc[nH]2)c1.Cc1cccc(-c2cccs2)c1.Cc1cccc(-c2ccsc2)c1.Cc1cccc(-c2cn[nH]c2)c1.Cc1cccc(-c2cn[nH]n2)c1.Cc1cccc(-c2nncn2C)c1.Cc1cccc(N2CCN(C)CC2)c1.

What is the InChIKey of 5-(3-chloro-5-methylphenyl)-1,3-thiazole;2-iodo-1-methoxy-4-methylbenzene;2-(2-methoxy-5-methylphenyl)-1H-pyrrole;5-(2-methoxy-5-methylphenyl)-1,3-thiazole;3-(2-methoxy-5-methylphenyl)thiophene;6-methyl-1H-benzimidazol-2-amine;6-methyl-1,3-benzothiazol-2-amine;1-methyl-4-(3-methylphenyl)piperazine;4-methyl-3-(3-methylphenyl)-1,2,4-triazole;4-(3-methylphenyl)-1H-pyrazole;2-(3-methylphenyl)-1H-pyrrole;2-(3-methylphenyl)thiophene;3-(3-methylphenyl)thiophene;4-(3-methylphenyl)-2H-triazole;5-methyl-1H-pyridin-2-one;4-methyl-2-(1,3-thiazol-5-yl)phenol?

The InChIKey is ZMOJOILNFFOUQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2.C12H13NO.C12H12OS.C11H11NOS.C11H11N.2C11H10S.C10H8ClNS.C10H11N3.C10H10N2.C10H9NOS.C9H9N3.C8H9IO.C8H9N3.C8H8N2S.C6H7NO/c1-11-4-3-5-12(10-11)14-8-6-13(2)7-9-14;1-9-5-6-12(14-2)10(8-9)11-4-3-7-13-11;1-9-3-4-12(13-2)11(7-9)10-5-6-14-8-10;1-8-3-4-10(13-2)9(5-8)11-6-12-7-14-11;2*1-9-4-2-5-10(8-9)11-6-3-7-12-11;1-9-3-2-4-10(7-9)11-5-6-12-8-11;1-7-2-8(4-9(11)3-7)10-5-12-6-13-10;1-8-4-3-5-9(6-8)10-12-11-7-13(10)2;1-8-3-2-4-9(5-8)10-6-11-12-7-10;1-7-2-3-9(12)8(4-7)10-5-11-6-13-10;1-7-3-2-4-8(5-7)9-6-10-12-11-9;1-6-3-4-8(10-2)7(9)5-6;2*1-5-2-3-6-7(4-5)11-8(9)10-6;1-5-2-3-6(8)7-4-5/h3-5,10H,6-9H2,1-2H3;3-8,13H,1-2H3;3-8H,1-2H3;3-7H,1-2H3;2-8,12H,1H3;2*2-8H,1H3;2-6H,1H3;3-7H,1-2H3;2-7H,1H3,(H,11,12);2-6,12H,1H3;2-6H,1H3,(H,10,11,12);3-5H,1-2H3;2-4H,1H3,(H3,9,10,11);2-4H,1H3,(H2,9,10);2-4H,1H3,(H,7,8).

What are the key properties of 5-(3-chloro-5-methylphenyl)-1,3-thiazole;2-iodo-1-methoxy-4-methylbenzene;2-(2-methoxy-5-methylphenyl)-1H-pyrrole;5-(2-methoxy-5-methylphenyl)-1,3-thiazole;3-(2-methoxy-5-methylphenyl)thiophene;6-methyl-1H-benzimidazol-2-amine;6-methyl-1,3-benzothiazol-2-amine;1-methyl-4-(3-methylphenyl)piperazine;4-methyl-3-(3-methylphenyl)-1,2,4-triazole;4-(3-methylphenyl)-1H-pyrazole;2-(3-methylphenyl)-1H-pyrrole;2-(3-methylphenyl)thiophene;3-(3-methylphenyl)thiophene;4-(3-methylphenyl)-2H-triazole;5-methyl-1H-pyridin-2-one;4-methyl-2-(1,3-thiazol-5-yl)phenol?

5-(3-chloro-5-methylphenyl)-1,3-thiazole;2-iodo-1-methoxy-4-methylbenzene;2-(2-methoxy-5-methylphenyl)-1H-pyrrole;5-(2-methoxy-5-methylphenyl)-1,3-thiazole;3-(2-methoxy-5-methylphenyl)thiophene;6-methyl-1H-benzimidazol-2-amine;6-methyl-1,3-benzothiazol-2-amine;1-methyl-4-(3-methylphenyl)piperazine;4-methyl-3-(3-methylphenyl)-1,2,4-triazole;4-(3-methylphenyl)-1H-pyrazole;2-(3-methylphenyl)-1H-pyrrole;2-(3-methylphenyl)thiophene;3-(3-methylphenyl)thiophene;4-(3-methylphenyl)-2H-triazole;5-methyl-1H-pyridin-2-one;4-methyl-2-(1,3-thiazol-5-yl)phenol has a molecular weight of 2853.04 g/mol, XLogP of 41.53, 16 rotatable bonds, 9 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(3-chloro-5-methylphenyl)-1,3-thiazole;2-iodo-1-methoxy-4-methylbenzene;2-(2-methoxy-5-methylphenyl)-1H-pyrrole;5-(2-methoxy-5-methylphenyl)-1,3-thiazole;3-(2-methoxy-5-methylphenyl)thiophene;6-methyl-1H-benzimidazol-2-amine;6-methyl-1,3-benzothiazol-2-amine;1-methyl-4-(3-methylphenyl)piperazine;4-methyl-3-(3-methylphenyl)-1,2,4-triazole;4-(3-methylphenyl)-1H-pyrazole;2-(3-methylphenyl)-1H-pyrrole;2-(3-methylphenyl)thiophene;3-(3-methylphenyl)thiophene;4-(3-methylphenyl)-2H-triazole;5-methyl-1H-pyridin-2-one;4-methyl-2-(1,3-thiazol-5-yl)phenol is sourced from PubChem (CID 162161676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).