3-chloro-6-methyl-1-benzofuran;5-chloro-2-methyl-1-benzofuran;3-chloro-6-methyl-1-benzothiophene;5-chloro-2-methyl-1-benzothiophene;6-chloro-2-methyl-1-benzothiophene;3-chloro-6-methylfuro[2,3-b]pyridine;5-chloro-2-methylfuro[2,3-b]pyridine;3-chloro-6-methylfuro[3,2-c]pyridine;3-chloro-6-methyl-2H-indazole;5-chloro-2-methyl-1H-indole;2-chloro-6-methylquinoline;3-chloro-7-methylquinoline;7-chloro-3-methylquinoline;3-chloro-6-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;3-chloro-6-methylthieno[3,2-c]pyridine;3,5-dichloro-2-methylthiophene

C153H120Cl19N13O5S8 — CID 161042866

About 3-chloro-6-methyl-1-benzofuran;5-chloro-2-methyl-1-benzofuran;3-chloro-6-methyl-1-benzothiophene;5-chloro-2-methyl-1-benzothiophene;6-chloro-2-methyl-1-benzothiophene;3-chloro-6-methylfuro[2,3-b]pyridine;5-chloro-2-methylfuro[2,3-b]pyridine;3-chloro-6-methylfuro[3,2-c]pyridine;3-chloro-6-methyl-2H-indazole;5-chloro-2-methyl-1H-indole;2-chloro-6-methylquinoline;3-chloro-7-methylquinoline;7-chloro-3-methylquinoline;3-chloro-6-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;3-chloro-6-methylthieno[3,2-c]pyridine;3,5-dichloro-2-methylthiophene

3-chloro-6-methyl-1-benzofuran;5-chloro-2-methyl-1-benzofuran;3-chloro-6-methyl-1-benzothiophene;5-chloro-2-methyl-1-benzothiophene;6-chloro-2-methyl-1-benzothiophene;3-chloro-6-methylfuro[2,3-b]pyridine;5-chloro-2-methylfuro[2,3-b]pyridine;3-chloro-6-methylfuro[3,2-c]pyridine;3-chloro-6-methyl-2H-indazole;5-chloro-2-methyl-1H-indole;2-chloro-6-methylquinoline;3-chloro-7-methylquinoline;7-chloro-3-methylquinoline;3-chloro-6-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;3-chloro-6-methylthieno[3,2-c]pyridine;3,5-dichloro-2-methylthiophene (PubChem CID 161042866) has the molecular formula C153H120Cl19N13O5S8 and a molecular weight of 3150.87 g/mol. Its IUPAC name is 3-chloro-6-methyl-1-benzofuran;5-chloro-2-methyl-1-benzofuran;3-chloro-6-methyl-1-benzothiophene;5-chloro-2-methyl-1-benzothiophene;6-chloro-2-methyl-1-benzothiophene;3-chloro-6-methylfuro[2,3-b]pyridine;5-chloro-2-methylfuro[2,3-b]pyridine;3-chloro-6-methylfuro[3,2-c]pyridine;3-chloro-6-methyl-2H-indazole;5-chloro-2-methyl-1H-indole;2-chloro-6-methylquinoline;3-chloro-7-methylquinoline;7-chloro-3-methylquinoline;3-chloro-6-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;3-chloro-6-methylthieno[3,2-c]pyridine;3,5-dichloro-2-methylthiophene.

Molecular Properties

• Compound Name: 3-chloro-6-methyl-1-benzofuran;5-chloro-2-methyl-1-benzofuran;3-chloro-6-methyl-1-benzothiophene;5-chloro-2-methyl-1-benzothiophene;6-chloro-2-methyl-1-benzothiophene;3-chloro-6-methylfuro[2,3-b]pyridine;5-chloro-2-methylfuro[2,3-b]pyridine;3-chloro-6-methylfuro[3,2-c]pyridine;3-chloro-6-methyl-2H-indazole;5-chloro-2-methyl-1H-indole;2-chloro-6-methylquinoline;3-chloro-7-methylquinoline;7-chloro-3-methylquinoline;3-chloro-6-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;3-chloro-6-methylthieno[3,2-c]pyridine;3,5-dichloro-2-methylthiophene
• PubChem CID: 161042866
• Molecular Formula: C153H120Cl19N13O5S8
• Molecular Weight: 3150.87 g/mol
• Exact Mass: 3139.14
• IUPAC Name: 3-chloro-6-methyl-1-benzofuran;5-chloro-2-methyl-1-benzofuran;3-chloro-6-methyl-1-benzothiophene;5-chloro-2-methyl-1-benzothiophene;6-chloro-2-methyl-1-benzothiophene;3-chloro-6-methylfuro[2,3-b]pyridine;5-chloro-2-methylfuro[2,3-b]pyridine;3-chloro-6-methylfuro[3,2-c]pyridine;3-chloro-6-methyl-2H-indazole;5-chloro-2-methyl-1H-indole;2-chloro-6-methylquinoline;3-chloro-7-methylquinoline;7-chloro-3-methylquinoline;3-chloro-6-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;3-chloro-6-methylthieno[3,2-c]pyridine;3,5-dichloro-2-methylthiophene
• SMILES: Cc1cc2cc(Cl)ccc2[nH]1.Cc1cc2cc(Cl)ccc2o1.Cc1cc2cc(Cl)ccc2s1.Cc1cc2cc(Cl)cnc2o1.Cc1cc2ccc(Cl)cc2s1.Cc1cc2ccc(Cl)nc2s1.Cc1cc2ncc(Cl)cc2s1.Cc1cc2occ(Cl)c2cn1.Cc1cc2scc(Cl)c2cn1.Cc1ccc2c(Cl)[nH]nc2c1.Cc1ccc2c(Cl)coc2c1.Cc1ccc2c(Cl)coc2n1.Cc1ccc2c(Cl)csc2c1.Cc1ccc2c(Cl)csc2n1.Cc1ccc2cc(Cl)cnc2c1.Cc1ccc2nc(Cl)ccc2c1.Cc1cnc2cc(Cl)ccc2c1.Cc1sc(Cl)cc1Cl
• InChI: InChI=1S/3C10H8ClN.C9H8ClN.2C9H7ClO.3C9H7ClS.C8H7ClN2.3C8H6ClNO.4C8H6ClNS.C5H4Cl2S/c1-7-2-4-9-8(6-7)3-5-10(11)12-9;1-7-4-8-2-3-9(11)5-10(8)12-6-7;1-7-2-3-8-5-9(11)6-12-10(8)4-7;2*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;1-6-4-7-5-8(10)2-3-9(7)11-6;1-6-4-7-2-3-8(10)5-9(7)11-6;1-6-2-3-7-8(10)5-11-9(7)4-6;1-5-2-3-6-7(4-5)10-11-8(6)9;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;1-5-2-3-6-7(9)4-11-8(6)10-5;1-5-2-8-6(3-10-5)7(9)4-11-8;1-5-2-7-8(11-5)3-6(9)4-10-7;1-5-4-6-2-3-7(9)10-8(6)11-5;1-5-2-3-6-7(9)4-11-8(6)10-5;1-3-4(6)2-5(7)8-3/h3*2-6H,1H3;2-5,11H,1H3;5*2-5H,1H3;2-4H,1H3,(H,10,11);7*2-4H,1H3;2H,1H3
• InChIKey: UBCLXOZHTJQNSO-UHFFFAOYSA-N
• XLogP: 58.39
• TPSA: 239.07 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 24
• Heavy Atoms: 198
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3150.87
LogP ≤ 5	58.39
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-methyl-1-benzofuran;5-chloro-2-methyl-1-benzofuran;3-chloro-6-methyl-1-benzothiophene;5-chloro-2-methyl-1-benzothiophene;6-chloro-2-methyl-1-benzothiophene;3-chloro-6-methylfuro[2,3-b]pyridine;5-chloro-2-methylfuro[2,3-b]pyridine;3-chloro-6-methylfuro[3,2-c]pyridine;3-chloro-6-methyl-2H-indazole;5-chloro-2-methyl-1H-indole;2-chloro-6-methylquinoline;3-chloro-7-methylquinoline;7-chloro-3-methylquinoline;3-chloro-6-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;3-chloro-6-methylthieno[3,2-c]pyridine;3,5-dichloro-2-methylthiophene?

The IUPAC name of 3-chloro-6-methyl-1-benzofuran;5-chloro-2-methyl-1-benzofuran;3-chloro-6-methyl-1-benzothiophene;5-chloro-2-methyl-1-benzothiophene;6-chloro-2-methyl-1-benzothiophene;3-chloro-6-methylfuro[2,3-b]pyridine;5-chloro-2-methylfuro[2,3-b]pyridine;3-chloro-6-methylfuro[3,2-c]pyridine;3-chloro-6-methyl-2H-indazole;5-chloro-2-methyl-1H-indole;2-chloro-6-methylquinoline;3-chloro-7-methylquinoline;7-chloro-3-methylquinoline;3-chloro-6-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;3-chloro-6-methylthieno[3,2-c]pyridine;3,5-dichloro-2-methylthiophene (CID 161042866) is 3-chloro-6-methyl-1-benzofuran;5-chloro-2-methyl-1-benzofuran;3-chloro-6-methyl-1-benzothiophene;5-chloro-2-methyl-1-benzothiophene;6-chloro-2-methyl-1-benzothiophene;3-chloro-6-methylfuro[2,3-b]pyridine;5-chloro-2-methylfuro[2,3-b]pyridine;3-chloro-6-methylfuro[3,2-c]pyridine;3-chloro-6-methyl-2H-indazole;5-chloro-2-methyl-1H-indole;2-chloro-6-methylquinoline;3-chloro-7-methylquinoline;7-chloro-3-methylquinoline;3-chloro-6-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;3-chloro-6-methylthieno[3,2-c]pyridine;3,5-dichloro-2-methylthiophene.

What is the SMILES notation for 3-chloro-6-methyl-1-benzofuran;5-chloro-2-methyl-1-benzofuran;3-chloro-6-methyl-1-benzothiophene;5-chloro-2-methyl-1-benzothiophene;6-chloro-2-methyl-1-benzothiophene;3-chloro-6-methylfuro[2,3-b]pyridine;5-chloro-2-methylfuro[2,3-b]pyridine;3-chloro-6-methylfuro[3,2-c]pyridine;3-chloro-6-methyl-2H-indazole;5-chloro-2-methyl-1H-indole;2-chloro-6-methylquinoline;3-chloro-7-methylquinoline;7-chloro-3-methylquinoline;3-chloro-6-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;3-chloro-6-methylthieno[3,2-c]pyridine;3,5-dichloro-2-methylthiophene?

The canonical SMILES for 3-chloro-6-methyl-1-benzofuran;5-chloro-2-methyl-1-benzofuran;3-chloro-6-methyl-1-benzothiophene;5-chloro-2-methyl-1-benzothiophene;6-chloro-2-methyl-1-benzothiophene;3-chloro-6-methylfuro[2,3-b]pyridine;5-chloro-2-methylfuro[2,3-b]pyridine;3-chloro-6-methylfuro[3,2-c]pyridine;3-chloro-6-methyl-2H-indazole;5-chloro-2-methyl-1H-indole;2-chloro-6-methylquinoline;3-chloro-7-methylquinoline;7-chloro-3-methylquinoline;3-chloro-6-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;3-chloro-6-methylthieno[3,2-c]pyridine;3,5-dichloro-2-methylthiophene is Cc1cc2cc(Cl)ccc2[nH]1.Cc1cc2cc(Cl)ccc2o1.Cc1cc2cc(Cl)ccc2s1.Cc1cc2cc(Cl)cnc2o1.Cc1cc2ccc(Cl)cc2s1.Cc1cc2ccc(Cl)nc2s1.Cc1cc2ncc(Cl)cc2s1.Cc1cc2occ(Cl)c2cn1.Cc1cc2scc(Cl)c2cn1.Cc1ccc2c(Cl)[nH]nc2c1.Cc1ccc2c(Cl)coc2c1.Cc1ccc2c(Cl)coc2n1.Cc1ccc2c(Cl)csc2c1.Cc1ccc2c(Cl)csc2n1.Cc1ccc2cc(Cl)cnc2c1.Cc1ccc2nc(Cl)ccc2c1.Cc1cnc2cc(Cl)ccc2c1.Cc1sc(Cl)cc1Cl.

What is the InChIKey of 3-chloro-6-methyl-1-benzofuran;5-chloro-2-methyl-1-benzofuran;3-chloro-6-methyl-1-benzothiophene;5-chloro-2-methyl-1-benzothiophene;6-chloro-2-methyl-1-benzothiophene;3-chloro-6-methylfuro[2,3-b]pyridine;5-chloro-2-methylfuro[2,3-b]pyridine;3-chloro-6-methylfuro[3,2-c]pyridine;3-chloro-6-methyl-2H-indazole;5-chloro-2-methyl-1H-indole;2-chloro-6-methylquinoline;3-chloro-7-methylquinoline;7-chloro-3-methylquinoline;3-chloro-6-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;3-chloro-6-methylthieno[3,2-c]pyridine;3,5-dichloro-2-methylthiophene?

The InChIKey is UBCLXOZHTJQNSO-UHFFFAOYSA-N. The full InChI is InChI=1S/3C10H8ClN.C9H8ClN.2C9H7ClO.3C9H7ClS.C8H7ClN2.3C8H6ClNO.4C8H6ClNS.C5H4Cl2S/c1-7-2-4-9-8(6-7)3-5-10(11)12-9;1-7-4-8-2-3-9(11)5-10(8)12-6-7;1-7-2-3-8-5-9(11)6-12-10(8)4-7;2*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;1-6-4-7-5-8(10)2-3-9(7)11-6;1-6-4-7-2-3-8(10)5-9(7)11-6;1-6-2-3-7-8(10)5-11-9(7)4-6;1-5-2-3-6-7(4-5)10-11-8(6)9;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;1-5-2-3-6-7(9)4-11-8(6)10-5;1-5-2-8-6(3-10-5)7(9)4-11-8;1-5-2-7-8(11-5)3-6(9)4-10-7;1-5-4-6-2-3-7(9)10-8(6)11-5;1-5-2-3-6-7(9)4-11-8(6)10-5;1-3-4(6)2-5(7)8-3/h3*2-6H,1H3;2-5,11H,1H3;5*2-5H,1H3;2-4H,1H3,(H,10,11);7*2-4H,1H3;2H,1H3.

What are the key properties of 3-chloro-6-methyl-1-benzofuran;5-chloro-2-methyl-1-benzofuran;3-chloro-6-methyl-1-benzothiophene;5-chloro-2-methyl-1-benzothiophene;6-chloro-2-methyl-1-benzothiophene;3-chloro-6-methylfuro[2,3-b]pyridine;5-chloro-2-methylfuro[2,3-b]pyridine;3-chloro-6-methylfuro[3,2-c]pyridine;3-chloro-6-methyl-2H-indazole;5-chloro-2-methyl-1H-indole;2-chloro-6-methylquinoline;3-chloro-7-methylquinoline;7-chloro-3-methylquinoline;3-chloro-6-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;3-chloro-6-methylthieno[3,2-c]pyridine;3,5-dichloro-2-methylthiophene?

3-chloro-6-methyl-1-benzofuran;5-chloro-2-methyl-1-benzofuran;3-chloro-6-methyl-1-benzothiophene;5-chloro-2-methyl-1-benzothiophene;6-chloro-2-methyl-1-benzothiophene;3-chloro-6-methylfuro[2,3-b]pyridine;5-chloro-2-methylfuro[2,3-b]pyridine;3-chloro-6-methylfuro[3,2-c]pyridine;3-chloro-6-methyl-2H-indazole;5-chloro-2-methyl-1H-indole;2-chloro-6-methylquinoline;3-chloro-7-methylquinoline;7-chloro-3-methylquinoline;3-chloro-6-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;3-chloro-6-methylthieno[3,2-c]pyridine;3,5-dichloro-2-methylthiophene has a molecular weight of 3150.87 g/mol, XLogP of 58.39, 0 rotatable bonds, 2 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 3-chloro-6-methyl-1-benzofuran;5-chloro-2-methyl-1-benzofuran;3-chloro-6-methyl-1-benzothiophene;5-chloro-2-methyl-1-benzothiophene;6-chloro-2-methyl-1-benzothiophene;3-chloro-6-methylfuro[2,3-b]pyridine;5-chloro-2-methylfuro[2,3-b]pyridine;3-chloro-6-methylfuro[3,2-c]pyridine;3-chloro-6-methyl-2H-indazole;5-chloro-2-methyl-1H-indole;2-chloro-6-methylquinoline;3-chloro-7-methylquinoline;7-chloro-3-methylquinoline;3-chloro-6-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;3-chloro-6-methylthieno[3,2-c]pyridine;3,5-dichloro-2-methylthiophene is sourced from PubChem (CID 161042866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).