2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methylimidazo[1,2-a]pyridine;2-methyl-3H-indole;2-methylpyrazolo[1,5-a]pyridine;2-methyl-3H-pyrrolo[2,3-b]pyridine;7-methyl-5H-pyrrolo[3,4-b]pyridine;2-methyl-3H-pyrrolo[2,3-c]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine

C73H75N15OS — CID 158735251

About 2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methylimidazo[1,2-a]pyridine;2-methyl-3H-indole;2-methylpyrazolo[1,5-a]pyridine;2-methyl-3H-pyrrolo[2,3-b]pyridine;7-methyl-5H-pyrrolo[3,4-b]pyridine;2-methyl-3H-pyrrolo[2,3-c]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine

2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methylimidazo[1,2-a]pyridine;2-methyl-3H-indole;2-methylpyrazolo[1,5-a]pyridine;2-methyl-3H-pyrrolo[2,3-b]pyridine;7-methyl-5H-pyrrolo[3,4-b]pyridine;2-methyl-3H-pyrrolo[2,3-c]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine (PubChem CID 158735251) has the molecular formula C73H75N15OS and a molecular weight of 1210.57 g/mol. Its IUPAC name is 2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methylimidazo[1,2-a]pyridine;2-methyl-3H-indole;2-methylpyrazolo[1,5-a]pyridine;2-methyl-3H-pyrrolo[2,3-b]pyridine;7-methyl-5H-pyrrolo[3,4-b]pyridine;2-methyl-3H-pyrrolo[2,3-c]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine.

Molecular Properties

• Compound Name: 2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methylimidazo[1,2-a]pyridine;2-methyl-3H-indole;2-methylpyrazolo[1,5-a]pyridine;2-methyl-3H-pyrrolo[2,3-b]pyridine;7-methyl-5H-pyrrolo[3,4-b]pyridine;2-methyl-3H-pyrrolo[2,3-c]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
• PubChem CID: 158735251
• Molecular Formula: C73H75N15OS
• Molecular Weight: 1210.57 g/mol
• Exact Mass: 1209.60
• IUPAC Name: 2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methylimidazo[1,2-a]pyridine;2-methyl-3H-indole;2-methylpyrazolo[1,5-a]pyridine;2-methyl-3H-pyrrolo[2,3-b]pyridine;7-methyl-5H-pyrrolo[3,4-b]pyridine;2-methyl-3H-pyrrolo[2,3-c]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
• SMILES: CC1=NCc2cccnc21.CC1=Nc2ccccc2C1.CC1=Nc2cnccc2C1.CC1=Nc2ncccc2C1.Cc1cc2ccccn2n1.Cc1cn2c(n1)CCCC2.Cc1cn2ccccc2n1.Cc1nc2ccccc2o1.Cc1nc2ccccc2s1
• InChI: InChI=1S/C9H9N.3C8H8N2.C8H12N2.2C8H8N2.C8H7NO.C8H7NS/c1-7-6-8-4-2-3-5-9(8)10-7;1-6-4-7-2-3-9-5-8(7)10-6;1-6-8-7(5-10-6)3-2-4-9-8;1-6-5-7-3-2-4-9-8(7)10-6;2*1-7-6-10-5-3-2-4-8(10)9-7;1-7-6-8-4-2-3-5-10(8)9-7;2*1-6-9-7-4-2-3-5-8(7)10-6/h2-5H,6H2,1H3;2-3,5H,4H2,1H3;2*2-4H,5H2,1H3;6H,2-5H2,1H3;2*2-6H,1H3;2*2-5H,1H3
• InChIKey: ILPDVXOIWQWNDD-UHFFFAOYSA-N
• XLogP: 16.75
• TPSA: 179.45 Ų
• H-Bond Acceptors: 17
• Heavy Atoms: 90
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1210.57
LogP ≤ 5	16.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methylimidazo[1,2-a]pyridine;2-methyl-3H-indole;2-methylpyrazolo[1,5-a]pyridine;2-methyl-3H-pyrrolo[2,3-b]pyridine;7-methyl-5H-pyrrolo[3,4-b]pyridine;2-methyl-3H-pyrrolo[2,3-c]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?

The IUPAC name of 2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methylimidazo[1,2-a]pyridine;2-methyl-3H-indole;2-methylpyrazolo[1,5-a]pyridine;2-methyl-3H-pyrrolo[2,3-b]pyridine;7-methyl-5H-pyrrolo[3,4-b]pyridine;2-methyl-3H-pyrrolo[2,3-c]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine (CID 158735251) is 2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methylimidazo[1,2-a]pyridine;2-methyl-3H-indole;2-methylpyrazolo[1,5-a]pyridine;2-methyl-3H-pyrrolo[2,3-b]pyridine;7-methyl-5H-pyrrolo[3,4-b]pyridine;2-methyl-3H-pyrrolo[2,3-c]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine.

What is the SMILES notation for 2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methylimidazo[1,2-a]pyridine;2-methyl-3H-indole;2-methylpyrazolo[1,5-a]pyridine;2-methyl-3H-pyrrolo[2,3-b]pyridine;7-methyl-5H-pyrrolo[3,4-b]pyridine;2-methyl-3H-pyrrolo[2,3-c]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?

The canonical SMILES for 2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methylimidazo[1,2-a]pyridine;2-methyl-3H-indole;2-methylpyrazolo[1,5-a]pyridine;2-methyl-3H-pyrrolo[2,3-b]pyridine;7-methyl-5H-pyrrolo[3,4-b]pyridine;2-methyl-3H-pyrrolo[2,3-c]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine is CC1=NCc2cccnc21.CC1=Nc2ccccc2C1.CC1=Nc2cnccc2C1.CC1=Nc2ncccc2C1.Cc1cc2ccccn2n1.Cc1cn2c(n1)CCCC2.Cc1cn2ccccc2n1.Cc1nc2ccccc2o1.Cc1nc2ccccc2s1.

What is the InChIKey of 2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methylimidazo[1,2-a]pyridine;2-methyl-3H-indole;2-methylpyrazolo[1,5-a]pyridine;2-methyl-3H-pyrrolo[2,3-b]pyridine;7-methyl-5H-pyrrolo[3,4-b]pyridine;2-methyl-3H-pyrrolo[2,3-c]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?

The InChIKey is ILPDVXOIWQWNDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N.3C8H8N2.C8H12N2.2C8H8N2.C8H7NO.C8H7NS/c1-7-6-8-4-2-3-5-9(8)10-7;1-6-4-7-2-3-9-5-8(7)10-6;1-6-8-7(5-10-6)3-2-4-9-8;1-6-5-7-3-2-4-9-8(7)10-6;2*1-7-6-10-5-3-2-4-8(10)9-7;1-7-6-8-4-2-3-5-10(8)9-7;2*1-6-9-7-4-2-3-5-8(7)10-6/h2-5H,6H2,1H3;2-3,5H,4H2,1H3;2*2-4H,5H2,1H3;6H,2-5H2,1H3;2*2-6H,1H3;2*2-5H,1H3.

What are the key properties of 2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methylimidazo[1,2-a]pyridine;2-methyl-3H-indole;2-methylpyrazolo[1,5-a]pyridine;2-methyl-3H-pyrrolo[2,3-b]pyridine;7-methyl-5H-pyrrolo[3,4-b]pyridine;2-methyl-3H-pyrrolo[2,3-c]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?

2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methylimidazo[1,2-a]pyridine;2-methyl-3H-indole;2-methylpyrazolo[1,5-a]pyridine;2-methyl-3H-pyrrolo[2,3-b]pyridine;7-methyl-5H-pyrrolo[3,4-b]pyridine;2-methyl-3H-pyrrolo[2,3-c]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine has a molecular weight of 1210.57 g/mol, XLogP of 16.75, 0 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methylimidazo[1,2-a]pyridine;2-methyl-3H-indole;2-methylpyrazolo[1,5-a]pyridine;2-methyl-3H-pyrrolo[2,3-b]pyridine;7-methyl-5H-pyrrolo[3,4-b]pyridine;2-methyl-3H-pyrrolo[2,3-c]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine is sourced from PubChem (CID 158735251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).