3,5-dimethyl-2H-indazole;5,7-dimethyl-1H-indazole;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1,3-dihydroindol-2-one;5-methyl-1H-indazole;6-methyl-1H-indazole;6-methylquinoline;6-methyl-1,2,3,4-tetrahydroquinoline

C79H83N13O3 — CID 159321211

About 3,5-dimethyl-2H-indazole;5,7-dimethyl-1H-indazole;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1,3-dihydroindol-2-one;5-methyl-1H-indazole;6-methyl-1H-indazole;6-methylquinoline;6-methyl-1,2,3,4-tetrahydroquinoline

3,5-dimethyl-2H-indazole;5,7-dimethyl-1H-indazole;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1,3-dihydroindol-2-one;5-methyl-1H-indazole;6-methyl-1H-indazole;6-methylquinoline;6-methyl-1,2,3,4-tetrahydroquinoline (PubChem CID 159321211) has the molecular formula C79H83N13O3 and a molecular weight of 1262.62 g/mol. Its IUPAC name is 3,5-dimethyl-2H-indazole;5,7-dimethyl-1H-indazole;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1,3-dihydroindol-2-one;5-methyl-1H-indazole;6-methyl-1H-indazole;6-methylquinoline;6-methyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

• Compound Name: 3,5-dimethyl-2H-indazole;5,7-dimethyl-1H-indazole;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1,3-dihydroindol-2-one;5-methyl-1H-indazole;6-methyl-1H-indazole;6-methylquinoline;6-methyl-1,2,3,4-tetrahydroquinoline
• PubChem CID: 159321211
• Molecular Formula: C79H83N13O3
• Molecular Weight: 1262.62 g/mol
• Exact Mass: 1261.67
• IUPAC Name: 3,5-dimethyl-2H-indazole;5,7-dimethyl-1H-indazole;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1,3-dihydroindol-2-one;5-methyl-1H-indazole;6-methyl-1H-indazole;6-methylquinoline;6-methyl-1,2,3,4-tetrahydroquinoline
• SMILES: Cc1cc(C)c2[nH]ncc2c1.Cc1ccc2[nH]ncc2c1.Cc1ccc2c(c1)CC(=O)N2.Cc1ccc2c(c1)CCCN2.Cc1ccc2c(c1)OCO2.Cc1ccc2cn[nH]c2c1.Cc1ccc2n[nH]c(C)c2c1.Cc1ccc2nc[nH]c2c1.Cc1ccc2ncccc2c1
• InChI: InChI=1S/C10H13N.C10H9N.2C9H10N2.C9H9NO.3C8H8N2.C8H8O2/c2*1-8-4-5-10-9(7-8)3-2-6-11-10;1-6-3-7(2)9-8(4-6)5-10-11-9;1-6-3-4-9-8(5-6)7(2)10-11-9;1-6-2-3-8-7(4-6)5-9(11)10-8;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-8(4-6)10-5-9-7;1-6-2-3-7-5-9-10-8(7)4-6;1-6-2-3-7-8(4-6)10-5-9-7/h4-5,7,11H,2-3,6H2,1H3;2-7H,1H3;2*3-5H,1-2H3,(H,10,11);2-4H,5H2,1H3,(H,10,11);3*2-5H,1H3,(H,9,10);2-4H,5H2,1H3
• InChIKey: LDUCWMYXQNZACX-UHFFFAOYSA-N
• XLogP: 18.08
• TPSA: 215.88 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 10
• Heavy Atoms: 95
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1262.62
LogP ≤ 5	18.08
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	10

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-2H-indazole;5,7-dimethyl-1H-indazole;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1,3-dihydroindol-2-one;5-methyl-1H-indazole;6-methyl-1H-indazole;6-methylquinoline;6-methyl-1,2,3,4-tetrahydroquinoline?

The IUPAC name of 3,5-dimethyl-2H-indazole;5,7-dimethyl-1H-indazole;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1,3-dihydroindol-2-one;5-methyl-1H-indazole;6-methyl-1H-indazole;6-methylquinoline;6-methyl-1,2,3,4-tetrahydroquinoline (CID 159321211) is 3,5-dimethyl-2H-indazole;5,7-dimethyl-1H-indazole;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1,3-dihydroindol-2-one;5-methyl-1H-indazole;6-methyl-1H-indazole;6-methylquinoline;6-methyl-1,2,3,4-tetrahydroquinoline.

What is the SMILES notation for 3,5-dimethyl-2H-indazole;5,7-dimethyl-1H-indazole;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1,3-dihydroindol-2-one;5-methyl-1H-indazole;6-methyl-1H-indazole;6-methylquinoline;6-methyl-1,2,3,4-tetrahydroquinoline?

The canonical SMILES for 3,5-dimethyl-2H-indazole;5,7-dimethyl-1H-indazole;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1,3-dihydroindol-2-one;5-methyl-1H-indazole;6-methyl-1H-indazole;6-methylquinoline;6-methyl-1,2,3,4-tetrahydroquinoline is Cc1cc(C)c2[nH]ncc2c1.Cc1ccc2[nH]ncc2c1.Cc1ccc2c(c1)CC(=O)N2.Cc1ccc2c(c1)CCCN2.Cc1ccc2c(c1)OCO2.Cc1ccc2cn[nH]c2c1.Cc1ccc2n[nH]c(C)c2c1.Cc1ccc2nc[nH]c2c1.Cc1ccc2ncccc2c1.

What is the InChIKey of 3,5-dimethyl-2H-indazole;5,7-dimethyl-1H-indazole;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1,3-dihydroindol-2-one;5-methyl-1H-indazole;6-methyl-1H-indazole;6-methylquinoline;6-methyl-1,2,3,4-tetrahydroquinoline?

The InChIKey is LDUCWMYXQNZACX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N.C10H9N.2C9H10N2.C9H9NO.3C8H8N2.C8H8O2/c2*1-8-4-5-10-9(7-8)3-2-6-11-10;1-6-3-7(2)9-8(4-6)5-10-11-9;1-6-3-4-9-8(5-6)7(2)10-11-9;1-6-2-3-8-7(4-6)5-9(11)10-8;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-8(4-6)10-5-9-7;1-6-2-3-7-5-9-10-8(7)4-6;1-6-2-3-7-8(4-6)10-5-9-7/h4-5,7,11H,2-3,6H2,1H3;2-7H,1H3;2*3-5H,1-2H3,(H,10,11);2-4H,5H2,1H3,(H,10,11);3*2-5H,1H3,(H,9,10);2-4H,5H2,1H3.

What are the key properties of 3,5-dimethyl-2H-indazole;5,7-dimethyl-1H-indazole;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1,3-dihydroindol-2-one;5-methyl-1H-indazole;6-methyl-1H-indazole;6-methylquinoline;6-methyl-1,2,3,4-tetrahydroquinoline?

3,5-dimethyl-2H-indazole;5,7-dimethyl-1H-indazole;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1,3-dihydroindol-2-one;5-methyl-1H-indazole;6-methyl-1H-indazole;6-methylquinoline;6-methyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 1262.62 g/mol, XLogP of 18.08, 0 rotatable bonds, 7 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 3,5-dimethyl-2H-indazole;5,7-dimethyl-1H-indazole;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1,3-dihydroindol-2-one;5-methyl-1H-indazole;6-methyl-1H-indazole;6-methylquinoline;6-methyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 159321211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).