7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-imidazo[4,5-b]pyridine;3-methylquinoline;3-methyl-5,6,7,8-tetrahydroquinoline;6-methyl-[1,3]thiazolo[5,4-b]pyridine

C59H65N11O4S — CID 157079369

About 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-imidazo[4,5-b]pyridine;3-methylquinoline;3-methyl-5,6,7,8-tetrahydroquinoline;6-methyl-[1,3]thiazolo[5,4-b]pyridine

7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-imidazo[4,5-b]pyridine;3-methylquinoline;3-methyl-5,6,7,8-tetrahydroquinoline;6-methyl-[1,3]thiazolo[5,4-b]pyridine (PubChem CID 157079369) has the molecular formula C59H65N11O4S and a molecular weight of 1024.31 g/mol. Its IUPAC name is 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-imidazo[4,5-b]pyridine;3-methylquinoline;3-methyl-5,6,7,8-tetrahydroquinoline;6-methyl-[1,3]thiazolo[5,4-b]pyridine.

Molecular Properties

• Compound Name: 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-imidazo[4,5-b]pyridine;3-methylquinoline;3-methyl-5,6,7,8-tetrahydroquinoline;6-methyl-[1,3]thiazolo[5,4-b]pyridine
• PubChem CID: 157079369
• Molecular Formula: C59H65N11O4S
• Molecular Weight: 1024.31 g/mol
• Exact Mass: 1023.49
• IUPAC Name: 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-imidazo[4,5-b]pyridine;3-methylquinoline;3-methyl-5,6,7,8-tetrahydroquinoline;6-methyl-[1,3]thiazolo[5,4-b]pyridine
• SMILES: Cc1cnc2c(c1)CCCC2.Cc1cnc2c(c1)CCCO2.Cc1cnc2c(c1)OCCN2.Cc1cnc2c(c1)OCCO2.Cc1cnc2ccccc2c1.Cc1cnc2nc[nH]c2c1.Cc1cnc2scnc2c1
• InChI: InChI=1S/C10H13N.C10H9N.C9H11NO.C8H10N2O.C8H9NO2.C7H7N3.C7H6N2S/c2*1-8-6-9-4-2-3-5-10(9)11-7-8;1-7-5-8-3-2-4-11-9(8)10-6-7;1-6-4-7-8(10-5-6)9-2-3-11-7;1-6-4-7-8(9-5-6)11-3-2-10-7;2*1-5-2-6-7(8-3-5)10-4-9-6/h6-7H,2-5H2,1H3;2-7H,1H3;5-6H,2-4H2,1H3;4-5H,2-3H2,1H3,(H,9,10);4-5H,2-3H2,1H3;2-4H,1H3,(H,8,9,10);2-4H,1H3
• InChIKey: ADIRLOICJCYGBE-UHFFFAOYSA-N
• XLogP: 12.15
• TPSA: 180.75 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 15
• Heavy Atoms: 75
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1024.31
LogP ≤ 5	12.15
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	15

Frequently Asked Questions

What is the IUPAC name of 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-imidazo[4,5-b]pyridine;3-methylquinoline;3-methyl-5,6,7,8-tetrahydroquinoline;6-methyl-[1,3]thiazolo[5,4-b]pyridine?

The IUPAC name of 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-imidazo[4,5-b]pyridine;3-methylquinoline;3-methyl-5,6,7,8-tetrahydroquinoline;6-methyl-[1,3]thiazolo[5,4-b]pyridine (CID 157079369) is 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-imidazo[4,5-b]pyridine;3-methylquinoline;3-methyl-5,6,7,8-tetrahydroquinoline;6-methyl-[1,3]thiazolo[5,4-b]pyridine.

What is the SMILES notation for 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-imidazo[4,5-b]pyridine;3-methylquinoline;3-methyl-5,6,7,8-tetrahydroquinoline;6-methyl-[1,3]thiazolo[5,4-b]pyridine?

The canonical SMILES for 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-imidazo[4,5-b]pyridine;3-methylquinoline;3-methyl-5,6,7,8-tetrahydroquinoline;6-methyl-[1,3]thiazolo[5,4-b]pyridine is Cc1cnc2c(c1)CCCC2.Cc1cnc2c(c1)CCCO2.Cc1cnc2c(c1)OCCN2.Cc1cnc2c(c1)OCCO2.Cc1cnc2ccccc2c1.Cc1cnc2nc[nH]c2c1.Cc1cnc2scnc2c1.

What is the InChIKey of 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-imidazo[4,5-b]pyridine;3-methylquinoline;3-methyl-5,6,7,8-tetrahydroquinoline;6-methyl-[1,3]thiazolo[5,4-b]pyridine?

The InChIKey is ADIRLOICJCYGBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N.C10H9N.C9H11NO.C8H10N2O.C8H9NO2.C7H7N3.C7H6N2S/c2*1-8-6-9-4-2-3-5-10(9)11-7-8;1-7-5-8-3-2-4-11-9(8)10-6-7;1-6-4-7-8(10-5-6)9-2-3-11-7;1-6-4-7-8(9-5-6)11-3-2-10-7;2*1-5-2-6-7(8-3-5)10-4-9-6/h6-7H,2-5H2,1H3;2-7H,1H3;5-6H,2-4H2,1H3;4-5H,2-3H2,1H3,(H,9,10);4-5H,2-3H2,1H3;2-4H,1H3,(H,8,9,10);2-4H,1H3.

What are the key properties of 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-imidazo[4,5-b]pyridine;3-methylquinoline;3-methyl-5,6,7,8-tetrahydroquinoline;6-methyl-[1,3]thiazolo[5,4-b]pyridine?

7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-imidazo[4,5-b]pyridine;3-methylquinoline;3-methyl-5,6,7,8-tetrahydroquinoline;6-methyl-[1,3]thiazolo[5,4-b]pyridine has a molecular weight of 1024.31 g/mol, XLogP of 12.15, 0 rotatable bonds, 2 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 7-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine;6-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine;7-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-methyl-1H-imidazo[4,5-b]pyridine;3-methylquinoline;3-methyl-5,6,7,8-tetrahydroquinoline;6-methyl-[1,3]thiazolo[5,4-b]pyridine is sourced from PubChem (CID 157079369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).