1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;6-methyl-1-benzofuran;6-methyl-1-benzothiophene;6-methyl-1,2-benzoxazole;bis(2-methyl-3H-indole);bis(6-methyl-3H-indole);5-methyl-1H-isoindole;2-methylquinazoline;2-methylquinoline;6-methylquinoline;8-methylquinoline

C156H154N20O2S — CID 158408641

About 1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;6-methyl-1-benzofuran;6-methyl-1-benzothiophene;6-methyl-1,2-benzoxazole;bis(2-methyl-3H-indole);bis(6-methyl-3H-indole);5-methyl-1H-isoindole;2-methylquinazoline;2-methylquinoline;6-methylquinoline;8-methylquinoline

1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;6-methyl-1-benzofuran;6-methyl-1-benzothiophene;6-methyl-1,2-benzoxazole;bis(2-methyl-3H-indole);bis(6-methyl-3H-indole);5-methyl-1H-isoindole;2-methylquinazoline;2-methylquinoline;6-methylquinoline;8-methylquinoline (PubChem CID 158408641) has the molecular formula C156H154N20O2S and a molecular weight of 2373.15 g/mol. Its IUPAC name is 1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;6-methyl-1-benzofuran;6-methyl-1-benzothiophene;6-methyl-1,2-benzoxazole;bis(2-methyl-3H-indole);bis(6-methyl-3H-indole);5-methyl-1H-isoindole;2-methylquinazoline;2-methylquinoline;6-methylquinoline;8-methylquinoline.

Molecular Properties

• Compound Name: 1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;6-methyl-1-benzofuran;6-methyl-1-benzothiophene;6-methyl-1,2-benzoxazole;bis(2-methyl-3H-indole);bis(6-methyl-3H-indole);5-methyl-1H-isoindole;2-methylquinazoline;2-methylquinoline;6-methylquinoline;8-methylquinoline
• PubChem CID: 158408641
• Molecular Formula: C156H154N20O2S
• Molecular Weight: 2373.15 g/mol
• Exact Mass: 2371.23
• IUPAC Name: 1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;6-methyl-1-benzofuran;6-methyl-1-benzothiophene;6-methyl-1,2-benzoxazole;bis(2-methyl-3H-indole);bis(6-methyl-3H-indole);5-methyl-1H-isoindole;2-methylquinazoline;2-methylquinoline;6-methylquinoline;8-methylquinoline
• SMILES: CC1=Nc2ccccc2C1.CC1=Nc2ccccc2C1.Cc1ccc2c(c1)C=NC2.Cc1ccc2c(c1)N=CC2.Cc1ccc2c(c1)N=CC2.Cc1ccc2c(c1)ncn2C.Cc1ccc2c(ccn2C)c1.Cc1ccc2c(cnn2C)c1.Cc1ccc2ccccc2n1.Cc1ccc2ccoc2c1.Cc1ccc2ccsc2c1.Cc1ccc2cnn(C)c2c1.Cc1ccc2cnoc2c1.Cc1ccc2ncccc2c1.Cc1cccc2cccnc12.Cc1nc2ccccc2n1C.Cc1ncc2ccccc2n1
• InChI: InChI=1S/C10H11N.3C10H9N.4C9H10N2.C9H8N2.5C9H9N.C9H8O.C9H8S.C8H7NO/c1-8-3-4-10-9(7-8)5-6-11(10)2;1-8-4-2-5-9-6-3-7-11-10(8)9;1-8-4-5-10-9(7-8)3-2-6-11-10;1-8-6-7-9-4-2-3-5-10(9)11-8;1-7-3-4-9-8(5-7)10-6-11(9)2;1-7-3-4-9-8(5-7)6-10-11(9)2;1-7-3-4-8-6-10-11(2)9(8)5-7;1-7-10-8-5-3-4-6-9(8)11(7)2;1-7-10-6-8-4-2-3-5-9(8)11-7;1-7-2-3-8-5-10-6-9(8)4-7;2*1-7-2-3-8-4-5-10-9(8)6-7;2*1-7-6-8-4-2-3-5-9(8)10-7;2*1-7-2-3-8-4-5-10-9(8)6-7;1-6-2-3-7-5-9-10-8(7)4-6/h3-7H,1-2H3;3*2-7H,1H3;4*3-6H,1-2H3;2-6H,1H3;2-4,6H,5H2,1H3;2*2-3,5-6H,4H2,1H3;2*2-5H,6H2,1H3;2*2-6H,1H3;2-5H,1H3
• InChIKey: GZACNFNYFVOIPO-UHFFFAOYSA-N
• XLogP: 38.77
• TPSA: 241.63 Ų
• H-Bond Acceptors: 23
• Heavy Atoms: 179
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2373.15
LogP ≤ 5	38.77
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;6-methyl-1-benzofuran;6-methyl-1-benzothiophene;6-methyl-1,2-benzoxazole;bis(2-methyl-3H-indole);bis(6-methyl-3H-indole);5-methyl-1H-isoindole;2-methylquinazoline;2-methylquinoline;6-methylquinoline;8-methylquinoline?

The IUPAC name of 1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;6-methyl-1-benzofuran;6-methyl-1-benzothiophene;6-methyl-1,2-benzoxazole;bis(2-methyl-3H-indole);bis(6-methyl-3H-indole);5-methyl-1H-isoindole;2-methylquinazoline;2-methylquinoline;6-methylquinoline;8-methylquinoline (CID 158408641) is 1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;6-methyl-1-benzofuran;6-methyl-1-benzothiophene;6-methyl-1,2-benzoxazole;bis(2-methyl-3H-indole);bis(6-methyl-3H-indole);5-methyl-1H-isoindole;2-methylquinazoline;2-methylquinoline;6-methylquinoline;8-methylquinoline.

What is the SMILES notation for 1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;6-methyl-1-benzofuran;6-methyl-1-benzothiophene;6-methyl-1,2-benzoxazole;bis(2-methyl-3H-indole);bis(6-methyl-3H-indole);5-methyl-1H-isoindole;2-methylquinazoline;2-methylquinoline;6-methylquinoline;8-methylquinoline?

The canonical SMILES for 1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;6-methyl-1-benzofuran;6-methyl-1-benzothiophene;6-methyl-1,2-benzoxazole;bis(2-methyl-3H-indole);bis(6-methyl-3H-indole);5-methyl-1H-isoindole;2-methylquinazoline;2-methylquinoline;6-methylquinoline;8-methylquinoline is CC1=Nc2ccccc2C1.CC1=Nc2ccccc2C1.Cc1ccc2c(c1)C=NC2.Cc1ccc2c(c1)N=CC2.Cc1ccc2c(c1)N=CC2.Cc1ccc2c(c1)ncn2C.Cc1ccc2c(ccn2C)c1.Cc1ccc2c(cnn2C)c1.Cc1ccc2ccccc2n1.Cc1ccc2ccoc2c1.Cc1ccc2ccsc2c1.Cc1ccc2cnn(C)c2c1.Cc1ccc2cnoc2c1.Cc1ccc2ncccc2c1.Cc1cccc2cccnc12.Cc1nc2ccccc2n1C.Cc1ncc2ccccc2n1.

What is the InChIKey of 1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;6-methyl-1-benzofuran;6-methyl-1-benzothiophene;6-methyl-1,2-benzoxazole;bis(2-methyl-3H-indole);bis(6-methyl-3H-indole);5-methyl-1H-isoindole;2-methylquinazoline;2-methylquinoline;6-methylquinoline;8-methylquinoline?

The InChIKey is GZACNFNYFVOIPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N.3C10H9N.4C9H10N2.C9H8N2.5C9H9N.C9H8O.C9H8S.C8H7NO/c1-8-3-4-10-9(7-8)5-6-11(10)2;1-8-4-2-5-9-6-3-7-11-10(8)9;1-8-4-5-10-9(7-8)3-2-6-11-10;1-8-6-7-9-4-2-3-5-10(9)11-8;1-7-3-4-9-8(5-7)10-6-11(9)2;1-7-3-4-9-8(5-7)6-10-11(9)2;1-7-3-4-8-6-10-11(2)9(8)5-7;1-7-10-8-5-3-4-6-9(8)11(7)2;1-7-10-6-8-4-2-3-5-9(8)11-7;1-7-2-3-8-5-10-6-9(8)4-7;2*1-7-2-3-8-4-5-10-9(8)6-7;2*1-7-6-8-4-2-3-5-9(8)10-7;2*1-7-2-3-8-4-5-10-9(8)6-7;1-6-2-3-7-5-9-10-8(7)4-6/h3-7H,1-2H3;3*2-7H,1H3;4*3-6H,1-2H3;2-6H,1H3;2-4,6H,5H2,1H3;2*2-3,5-6H,4H2,1H3;2*2-5H,6H2,1H3;2*2-6H,1H3;2-5H,1H3.

What are the key properties of 1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;6-methyl-1-benzofuran;6-methyl-1-benzothiophene;6-methyl-1,2-benzoxazole;bis(2-methyl-3H-indole);bis(6-methyl-3H-indole);5-methyl-1H-isoindole;2-methylquinazoline;2-methylquinoline;6-methylquinoline;8-methylquinoline?

1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;6-methyl-1-benzofuran;6-methyl-1-benzothiophene;6-methyl-1,2-benzoxazole;bis(2-methyl-3H-indole);bis(6-methyl-3H-indole);5-methyl-1H-isoindole;2-methylquinazoline;2-methylquinoline;6-methylquinoline;8-methylquinoline has a molecular weight of 2373.15 g/mol, XLogP of 38.77, 0 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 1,2-dimethylbenzimidazole;1,5-dimethylbenzimidazole;1,5-dimethylindazole;1,6-dimethylindazole;1,5-dimethylindole;6-methyl-1-benzofuran;6-methyl-1-benzothiophene;6-methyl-1,2-benzoxazole;bis(2-methyl-3H-indole);bis(6-methyl-3H-indole);5-methyl-1H-isoindole;2-methylquinazoline;2-methylquinoline;6-methylquinoline;8-methylquinoline is sourced from PubChem (CID 158408641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).