6-chloro-2-methyl-1H-benzimidazole;3-chloro-6-methyl-1H-indole;5-chloro-2-methyl-1H-indole;3-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;2-methoxy-6-methylnaphthalene;7-methoxy-3-methylquinoline;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine

C129H123Cl6N15O8S6 — CID 158064141

About 6-chloro-2-methyl-1H-benzimidazole;3-chloro-6-methyl-1H-indole;5-chloro-2-methyl-1H-indole;3-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;2-methoxy-6-methylnaphthalene;7-methoxy-3-methylquinoline;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine

6-chloro-2-methyl-1H-benzimidazole;3-chloro-6-methyl-1H-indole;5-chloro-2-methyl-1H-indole;3-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;2-methoxy-6-methylnaphthalene;7-methoxy-3-methylquinoline;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine (PubChem CID 158064141) has the molecular formula C129H123Cl6N15O8S6 and a molecular weight of 2416.62 g/mol. Its IUPAC name is 6-chloro-2-methyl-1H-benzimidazole;3-chloro-6-methyl-1H-indole;5-chloro-2-methyl-1H-indole;3-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;2-methoxy-6-methylnaphthalene;7-methoxy-3-methylquinoline;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine.

Molecular Properties

• Compound Name: 6-chloro-2-methyl-1H-benzimidazole;3-chloro-6-methyl-1H-indole;5-chloro-2-methyl-1H-indole;3-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;2-methoxy-6-methylnaphthalene;7-methoxy-3-methylquinoline;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine
• PubChem CID: 158064141
• Molecular Formula: C129H123Cl6N15O8S6
• Molecular Weight: 2416.62 g/mol
• Exact Mass: 2411.61
• IUPAC Name: 6-chloro-2-methyl-1H-benzimidazole;3-chloro-6-methyl-1H-indole;5-chloro-2-methyl-1H-indole;3-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;2-methoxy-6-methylnaphthalene;7-methoxy-3-methylquinoline;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine
• SMILES: COc1ccc2cc(C)ccc2c1.COc1ccc2cc(C)cnc2c1.COc1ccc2cc(C)sc2c1.COc1ccc2cc(C)sc2n1.COc1ccc2sc(C)cc2c1.COc1ccc2sc(C)cc2n1.COc1ccc2sc(C)nc2c1.COc1cnc2cc(C)sc2c1.Cc1cc2[nH]cc(Cl)c2cn1.Cc1cc2cc(Cl)ccc2[nH]1.Cc1cc2cc(Cl)cnc2[nH]1.Cc1ccc2c(Cl)c[nH]c2c1.Cc1ccc2c(Cl)c[nH]c2n1.Cc1nc2ccc(Cl)cc2[nH]1
• InChI: InChI=1S/C12H12O.C11H11NO.2C10H10OS.2C9H8ClN.4C9H9NOS.4C8H7ClN2/c1-9-3-4-11-8-12(13-2)6-5-10(11)7-9;1-8-5-9-3-4-10(13-2)6-11(9)12-7-8;1-7-5-8-6-9(11-2)3-4-10(8)12-7;1-7-5-8-3-4-9(11-2)6-10(8)12-7;1-6-4-7-5-8(10)2-3-9(7)11-6;1-6-2-3-7-8(10)5-11-9(7)4-6;1-6-3-8-9(12-6)4-7(11-2)5-10-8;1-6-10-8-5-7(11-2)3-4-9(8)12-6;1-6-5-7-8(12-6)3-4-9(10-7)11-2;1-6-5-7-3-4-8(11-2)10-9(7)12-6;1-5-2-8-6(3-10-5)7(9)4-11-8;1-5-2-6-3-7(9)4-10-8(6)11-5;1-5-10-7-3-2-6(9)4-8(7)11-5;1-5-2-3-6-7(9)4-10-8(6)11-5/h3-8H,1-2H3;3-7H,1-2H3;2*3-6H,1-2H3;2*2-5,11H,1H3;4*3-5H,1-2H3;2-4,11H,1H3;3*2-4H,1H3,(H,10,11)
• InChIKey: FLACLIIVVLFWIV-UHFFFAOYSA-N
• XLogP: 38.96
• TPSA: 284.59 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 23
• Rotatable Bonds: 8
• Heavy Atoms: 164
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2416.62
LogP ≤ 5	38.96
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-methyl-1H-benzimidazole;3-chloro-6-methyl-1H-indole;5-chloro-2-methyl-1H-indole;3-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;2-methoxy-6-methylnaphthalene;7-methoxy-3-methylquinoline;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine?

The IUPAC name of 6-chloro-2-methyl-1H-benzimidazole;3-chloro-6-methyl-1H-indole;5-chloro-2-methyl-1H-indole;3-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;2-methoxy-6-methylnaphthalene;7-methoxy-3-methylquinoline;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine (CID 158064141) is 6-chloro-2-methyl-1H-benzimidazole;3-chloro-6-methyl-1H-indole;5-chloro-2-methyl-1H-indole;3-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;2-methoxy-6-methylnaphthalene;7-methoxy-3-methylquinoline;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine.

What is the SMILES notation for 6-chloro-2-methyl-1H-benzimidazole;3-chloro-6-methyl-1H-indole;5-chloro-2-methyl-1H-indole;3-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;2-methoxy-6-methylnaphthalene;7-methoxy-3-methylquinoline;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine?

The canonical SMILES for 6-chloro-2-methyl-1H-benzimidazole;3-chloro-6-methyl-1H-indole;5-chloro-2-methyl-1H-indole;3-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;2-methoxy-6-methylnaphthalene;7-methoxy-3-methylquinoline;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine is COc1ccc2cc(C)ccc2c1.COc1ccc2cc(C)cnc2c1.COc1ccc2cc(C)sc2c1.COc1ccc2cc(C)sc2n1.COc1ccc2sc(C)cc2c1.COc1ccc2sc(C)cc2n1.COc1ccc2sc(C)nc2c1.COc1cnc2cc(C)sc2c1.Cc1cc2[nH]cc(Cl)c2cn1.Cc1cc2cc(Cl)ccc2[nH]1.Cc1cc2cc(Cl)cnc2[nH]1.Cc1ccc2c(Cl)c[nH]c2c1.Cc1ccc2c(Cl)c[nH]c2n1.Cc1nc2ccc(Cl)cc2[nH]1.

What is the InChIKey of 6-chloro-2-methyl-1H-benzimidazole;3-chloro-6-methyl-1H-indole;5-chloro-2-methyl-1H-indole;3-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;2-methoxy-6-methylnaphthalene;7-methoxy-3-methylquinoline;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine?

The InChIKey is FLACLIIVVLFWIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O.C11H11NO.2C10H10OS.2C9H8ClN.4C9H9NOS.4C8H7ClN2/c1-9-3-4-11-8-12(13-2)6-5-10(11)7-9;1-8-5-9-3-4-10(13-2)6-11(9)12-7-8;1-7-5-8-6-9(11-2)3-4-10(8)12-7;1-7-5-8-3-4-9(11-2)6-10(8)12-7;1-6-4-7-5-8(10)2-3-9(7)11-6;1-6-2-3-7-8(10)5-11-9(7)4-6;1-6-3-8-9(12-6)4-7(11-2)5-10-8;1-6-10-8-5-7(11-2)3-4-9(8)12-6;1-6-5-7-8(12-6)3-4-9(10-7)11-2;1-6-5-7-3-4-8(11-2)10-9(7)12-6;1-5-2-8-6(3-10-5)7(9)4-11-8;1-5-2-6-3-7(9)4-10-8(6)11-5;1-5-10-7-3-2-6(9)4-8(7)11-5;1-5-2-3-6-7(9)4-10-8(6)11-5/h3-8H,1-2H3;3-7H,1-2H3;2*3-6H,1-2H3;2*2-5,11H,1H3;4*3-5H,1-2H3;2-4,11H,1H3;3*2-4H,1H3,(H,10,11).

What are the key properties of 6-chloro-2-methyl-1H-benzimidazole;3-chloro-6-methyl-1H-indole;5-chloro-2-methyl-1H-indole;3-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;2-methoxy-6-methylnaphthalene;7-methoxy-3-methylquinoline;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine?

6-chloro-2-methyl-1H-benzimidazole;3-chloro-6-methyl-1H-indole;5-chloro-2-methyl-1H-indole;3-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;2-methoxy-6-methylnaphthalene;7-methoxy-3-methylquinoline;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine has a molecular weight of 2416.62 g/mol, XLogP of 38.96, 8 rotatable bonds, 6 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 6-chloro-2-methyl-1H-benzimidazole;3-chloro-6-methyl-1H-indole;5-chloro-2-methyl-1H-indole;3-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridine;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;2-methoxy-6-methylnaphthalene;7-methoxy-3-methylquinoline;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine is sourced from PubChem (CID 158064141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).