6-chloro-2-methyl-1-benzothiophene;2-chloro-6-methylquinoline;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;5-methyl-2H-benzotriazole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine

C113H108Cl4N28O2S5 — CID 161331105

About 6-chloro-2-methyl-1-benzothiophene;2-chloro-6-methylquinoline;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;5-methyl-2H-benzotriazole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine

6-chloro-2-methyl-1-benzothiophene;2-chloro-6-methylquinoline;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;5-methyl-2H-benzotriazole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine (PubChem CID 161331105) has the molecular formula C113H108Cl4N28O2S5 and a molecular weight of 2192.45 g/mol. Its IUPAC name is 6-chloro-2-methyl-1-benzothiophene;2-chloro-6-methylquinoline;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;5-methyl-2H-benzotriazole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine.

Molecular Properties

• Compound Name: 6-chloro-2-methyl-1-benzothiophene;2-chloro-6-methylquinoline;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;5-methyl-2H-benzotriazole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine
• PubChem CID: 161331105
• Molecular Formula: C113H108Cl4N28O2S5
• Molecular Weight: 2192.45 g/mol
• Exact Mass: 2188.66
• IUPAC Name: 6-chloro-2-methyl-1-benzothiophene;2-chloro-6-methylquinoline;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;5-methyl-2H-benzotriazole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine
• SMILES: Cc1cc2c(N)nccc2[nH]1.Cc1cc2c(N)nccc2o1.Cc1cc2c(N)nccc2s1.Cc1cc2ccc(Cl)cc2s1.Cc1cc2ccc(Cl)nc2s1.Cc1cc2ccnc(N)c2[nH]1.Cc1cc2ccnc(N)c2o1.Cc1cc2ccnc(N)c2s1.Cc1cc2ncc(Cl)cc2s1.Cc1ccc2[nH]ncc2c1.Cc1ccc2cn[nH]c2c1.Cc1ccc2n[nH]nc2c1.Cc1ccc2nc(Cl)ccc2c1.Cc1nc2c(N)nccc2[nH]1
• InChI: InChI=1S/C10H8ClN.C9H7ClS.2C8H6ClNS.2C8H9N3.2C8H8N2O.2C8H8N2S.2C8H8N2.C7H8N4.C7H7N3/c1-7-2-4-9-8(6-7)3-5-10(11)12-9;1-6-4-7-2-3-8(10)5-9(7)11-6;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;1-5-4-6-7(11-5)2-3-10-8(6)9;1-5-4-6-2-3-10-8(9)7(6)11-5;1-5-4-6-7(11-5)2-3-10-8(6)9;1-5-4-6-2-3-10-8(9)7(6)11-5;1-5-4-6-7(11-5)2-3-10-8(6)9;1-5-4-6-2-3-10-8(9)7(6)11-5;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-5-9-10-8(7)4-6;1-4-10-5-2-3-9-7(8)6(5)11-4;1-5-2-3-6-7(4-5)9-10-8-6/h2-6H,1H3;2-5H,1H3;2*2-4H,1H3;2*2-4,11H,1H3,(H2,9,10);4*2-4H,1H3,(H2,9,10);2*2-5H,1H3,(H,9,10);2-3H,1H3,(H2,8,9)(H,10,11);2-4H,1H3,(H,8,9,10)
• InChIKey: VLKUAWOLEBCLAN-UHFFFAOYSA-N
• XLogP: 30.15
• TPSA: 496.51 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 29
• Heavy Atoms: 152
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2192.45
LogP ≤ 5	30.15
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-methyl-1-benzothiophene;2-chloro-6-methylquinoline;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;5-methyl-2H-benzotriazole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine?

The IUPAC name of 6-chloro-2-methyl-1-benzothiophene;2-chloro-6-methylquinoline;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;5-methyl-2H-benzotriazole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine (CID 161331105) is 6-chloro-2-methyl-1-benzothiophene;2-chloro-6-methylquinoline;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;5-methyl-2H-benzotriazole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine.

What is the SMILES notation for 6-chloro-2-methyl-1-benzothiophene;2-chloro-6-methylquinoline;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;5-methyl-2H-benzotriazole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine?

The canonical SMILES for 6-chloro-2-methyl-1-benzothiophene;2-chloro-6-methylquinoline;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;5-methyl-2H-benzotriazole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine is Cc1cc2c(N)nccc2[nH]1.Cc1cc2c(N)nccc2o1.Cc1cc2c(N)nccc2s1.Cc1cc2ccc(Cl)cc2s1.Cc1cc2ccc(Cl)nc2s1.Cc1cc2ccnc(N)c2[nH]1.Cc1cc2ccnc(N)c2o1.Cc1cc2ccnc(N)c2s1.Cc1cc2ncc(Cl)cc2s1.Cc1ccc2[nH]ncc2c1.Cc1ccc2cn[nH]c2c1.Cc1ccc2n[nH]nc2c1.Cc1ccc2nc(Cl)ccc2c1.Cc1nc2c(N)nccc2[nH]1.

What is the InChIKey of 6-chloro-2-methyl-1-benzothiophene;2-chloro-6-methylquinoline;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;5-methyl-2H-benzotriazole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine?

The InChIKey is VLKUAWOLEBCLAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN.C9H7ClS.2C8H6ClNS.2C8H9N3.2C8H8N2O.2C8H8N2S.2C8H8N2.C7H8N4.C7H7N3/c1-7-2-4-9-8(6-7)3-5-10(11)12-9;1-6-4-7-2-3-8(10)5-9(7)11-6;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;1-5-4-6-7(11-5)2-3-10-8(6)9;1-5-4-6-2-3-10-8(9)7(6)11-5;1-5-4-6-7(11-5)2-3-10-8(6)9;1-5-4-6-2-3-10-8(9)7(6)11-5;1-5-4-6-7(11-5)2-3-10-8(6)9;1-5-4-6-2-3-10-8(9)7(6)11-5;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-5-9-10-8(7)4-6;1-4-10-5-2-3-9-7(8)6(5)11-4;1-5-2-3-6-7(4-5)9-10-8-6/h2-6H,1H3;2-5H,1H3;2*2-4H,1H3;2*2-4,11H,1H3,(H2,9,10);4*2-4H,1H3,(H2,9,10);2*2-5H,1H3,(H,9,10);2-3H,1H3,(H2,8,9)(H,10,11);2-4H,1H3,(H,8,9,10).

What are the key properties of 6-chloro-2-methyl-1-benzothiophene;2-chloro-6-methylquinoline;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;5-methyl-2H-benzotriazole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine?

6-chloro-2-methyl-1-benzothiophene;2-chloro-6-methylquinoline;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;5-methyl-2H-benzotriazole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine has a molecular weight of 2192.45 g/mol, XLogP of 30.15, 0 rotatable bonds, 13 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 6-chloro-2-methyl-1-benzothiophene;2-chloro-6-methylquinoline;6-chloro-2-methylthieno[2,3-b]pyridine;6-chloro-2-methylthieno[3,2-b]pyridine;5-methyl-2H-benzotriazole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 161331105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).