6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-benzimidazole;6-methyl-2,3-dihydro-1,3-benzothiazole;6-methyl-2,3-dihydro-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazole;5-methyl-1H-indole

C88H91N17OS4 — CID 161213343

About 6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-benzimidazole;6-methyl-2,3-dihydro-1,3-benzothiazole;6-methyl-2,3-dihydro-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazole;5-methyl-1H-indole

6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-benzimidazole;6-methyl-2,3-dihydro-1,3-benzothiazole;6-methyl-2,3-dihydro-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazole;5-methyl-1H-indole (PubChem CID 161213343) has the molecular formula C88H91N17OS4 and a molecular weight of 1531.08 g/mol. Its IUPAC name is 6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-benzimidazole;6-methyl-2,3-dihydro-1,3-benzothiazole;6-methyl-2,3-dihydro-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazole;5-methyl-1H-indole.

Molecular Properties

• Compound Name: 6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-benzimidazole;6-methyl-2,3-dihydro-1,3-benzothiazole;6-methyl-2,3-dihydro-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazole;5-methyl-1H-indole
• PubChem CID: 161213343
• Molecular Formula: C88H91N17OS4
• Molecular Weight: 1531.08 g/mol
• Exact Mass: 1529.65
• IUPAC Name: 6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-benzimidazole;6-methyl-2,3-dihydro-1,3-benzothiazole;6-methyl-2,3-dihydro-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazole;5-methyl-1H-indole
• SMILES: Cc1ccc2[nH]ccc2c1.Cc1ccc2[nH]ncc2c1.Cc1ccc2c(c1)CCN2.Cc1ccc2c(c1)NCN2.Cc1ccc2c(c1)OCN2.Cc1ccc2c(c1)SCN2.Cc1ccc2n[nH]nc2c1.Cc1ccc2nc[nH]c2c1.Cc1ccc2ncsc2c1.Cc1ccc2nsnc2c1.Cc1ccc2scnc2c1
• InChI: InChI=1S/C9H11N.C9H9N.C8H8N2.C8H10N2.C8H8N2.C8H9NO.C8H7NS.C8H9NS.C8H7NS.C7H7N3.C7H6N2S/c2*1-7-2-3-9-8(6-7)4-5-10-9;1-6-2-3-8-7(4-6)5-9-10-8;3*1-6-2-3-7-8(4-6)10-5-9-7;1-6-2-3-8-7(4-6)9-5-10-8;2*1-6-2-3-7-8(4-6)10-5-9-7;2*1-5-2-3-6-7(4-5)9-10-8-6/h2-3,6,10H,4-5H2,1H3;2-6,10H,1H3;2-5H,1H3,(H,9,10);2-4,9-10H,5H2,1H3;2-5H,1H3,(H,9,10);2-4,9H,5H2,1H3;2-5H,1H3;2-4,9H,5H2,1H3;2-5H,1H3;2-4H,1H3,(H,8,9,10);2-4H,1H3
• InChIKey: UWNLKNXIEQTIGC-UHFFFAOYSA-N
• XLogP: 22.67
• TPSA: 235.66 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 18
• Heavy Atoms: 110
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1531.08
LogP ≤ 5	22.67
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-benzimidazole;6-methyl-2,3-dihydro-1,3-benzothiazole;6-methyl-2,3-dihydro-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazole;5-methyl-1H-indole?

The IUPAC name of 6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-benzimidazole;6-methyl-2,3-dihydro-1,3-benzothiazole;6-methyl-2,3-dihydro-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazole;5-methyl-1H-indole (CID 161213343) is 6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-benzimidazole;6-methyl-2,3-dihydro-1,3-benzothiazole;6-methyl-2,3-dihydro-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazole;5-methyl-1H-indole.

What is the SMILES notation for 6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-benzimidazole;6-methyl-2,3-dihydro-1,3-benzothiazole;6-methyl-2,3-dihydro-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazole;5-methyl-1H-indole?

The canonical SMILES for 6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-benzimidazole;6-methyl-2,3-dihydro-1,3-benzothiazole;6-methyl-2,3-dihydro-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazole;5-methyl-1H-indole is Cc1ccc2[nH]ccc2c1.Cc1ccc2[nH]ncc2c1.Cc1ccc2c(c1)CCN2.Cc1ccc2c(c1)NCN2.Cc1ccc2c(c1)OCN2.Cc1ccc2c(c1)SCN2.Cc1ccc2n[nH]nc2c1.Cc1ccc2nc[nH]c2c1.Cc1ccc2ncsc2c1.Cc1ccc2nsnc2c1.Cc1ccc2scnc2c1.

What is the InChIKey of 6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-benzimidazole;6-methyl-2,3-dihydro-1,3-benzothiazole;6-methyl-2,3-dihydro-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazole;5-methyl-1H-indole?

The InChIKey is UWNLKNXIEQTIGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N.C9H9N.C8H8N2.C8H10N2.C8H8N2.C8H9NO.C8H7NS.C8H9NS.C8H7NS.C7H7N3.C7H6N2S/c2*1-7-2-3-9-8(6-7)4-5-10-9;1-6-2-3-8-7(4-6)5-9-10-8;3*1-6-2-3-7-8(4-6)10-5-9-7;1-6-2-3-8-7(4-6)9-5-10-8;2*1-6-2-3-7-8(4-6)10-5-9-7;2*1-5-2-3-6-7(4-5)9-10-8-6/h2-3,6,10H,4-5H2,1H3;2-6,10H,1H3;2-5H,1H3,(H,9,10);2-4,9-10H,5H2,1H3;2-5H,1H3,(H,9,10);2-4,9H,5H2,1H3;2-5H,1H3;2-4,9H,5H2,1H3;2-5H,1H3;2-4H,1H3,(H,8,9,10);2-4H,1H3.

What are the key properties of 6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-benzimidazole;6-methyl-2,3-dihydro-1,3-benzothiazole;6-methyl-2,3-dihydro-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazole;5-methyl-1H-indole?

6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-benzimidazole;6-methyl-2,3-dihydro-1,3-benzothiazole;6-methyl-2,3-dihydro-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazole;5-methyl-1H-indole has a molecular weight of 1531.08 g/mol, XLogP of 22.67, 0 rotatable bonds, 9 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-benzimidazole;6-methyl-2,3-dihydro-1,3-benzothiazole;6-methyl-2,3-dihydro-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazole;5-methyl-1H-indole is sourced from PubChem (CID 161213343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).