6,7-dihydro-5H-cyclopenta[b]pyridine;3,4-dihydro-2H-pyrano[2,3-b]pyridine;3,4-dihydro-2H-pyrano[3,2-b]pyridine;6,8-dihydro-5H-pyrano[3,4-b]pyridine;7,8-dihydro-5H-pyrano[4,3-b]pyridine;quinoline;5,6,7,8-tetrahydroquinoline;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[3,4-b]pyridine

C79H78N10O4S3 — CID 158631805

About 6,7-dihydro-5H-cyclopenta[b]pyridine;3,4-dihydro-2H-pyrano[2,3-b]pyridine;3,4-dihydro-2H-pyrano[3,2-b]pyridine;6,8-dihydro-5H-pyrano[3,4-b]pyridine;7,8-dihydro-5H-pyrano[4,3-b]pyridine;quinoline;5,6,7,8-tetrahydroquinoline;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[3,4-b]pyridine

6,7-dihydro-5H-cyclopenta[b]pyridine;3,4-dihydro-2H-pyrano[2,3-b]pyridine;3,4-dihydro-2H-pyrano[3,2-b]pyridine;6,8-dihydro-5H-pyrano[3,4-b]pyridine;7,8-dihydro-5H-pyrano[4,3-b]pyridine;quinoline;5,6,7,8-tetrahydroquinoline;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[3,4-b]pyridine (PubChem CID 158631805) has the molecular formula C79H78N10O4S3 and a molecular weight of 1327.76 g/mol. Its IUPAC name is 6,7-dihydro-5H-cyclopenta[b]pyridine;3,4-dihydro-2H-pyrano[2,3-b]pyridine;3,4-dihydro-2H-pyrano[3,2-b]pyridine;6,8-dihydro-5H-pyrano[3,4-b]pyridine;7,8-dihydro-5H-pyrano[4,3-b]pyridine;quinoline;5,6,7,8-tetrahydroquinoline;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[3,4-b]pyridine.

Molecular Properties

• Compound Name: 6,7-dihydro-5H-cyclopenta[b]pyridine;3,4-dihydro-2H-pyrano[2,3-b]pyridine;3,4-dihydro-2H-pyrano[3,2-b]pyridine;6,8-dihydro-5H-pyrano[3,4-b]pyridine;7,8-dihydro-5H-pyrano[4,3-b]pyridine;quinoline;5,6,7,8-tetrahydroquinoline;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[3,4-b]pyridine
• PubChem CID: 158631805
• Molecular Formula: C79H78N10O4S3
• Molecular Weight: 1327.76 g/mol
• Exact Mass: 1326.54
• IUPAC Name: 6,7-dihydro-5H-cyclopenta[b]pyridine;3,4-dihydro-2H-pyrano[2,3-b]pyridine;3,4-dihydro-2H-pyrano[3,2-b]pyridine;6,8-dihydro-5H-pyrano[3,4-b]pyridine;7,8-dihydro-5H-pyrano[4,3-b]pyridine;quinoline;5,6,7,8-tetrahydroquinoline;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[3,4-b]pyridine
• SMILES: c1ccc2ncccc2c1.c1cnc2c(c1)CCC2.c1cnc2c(c1)CCCC2.c1cnc2c(c1)CCCO2.c1cnc2c(c1)CCOC2.c1cnc2c(c1)COCC2.c1cnc2c(c1)OCCC2.c1cnc2ccsc2c1.c1cnc2cscc2c1.c1cnc2sccc2c1
• InChI: InChI=1S/C9H11N.C9H7N.4C8H9NO.C8H9N.3C7H5NS/c2*1-2-6-9-8(4-1)5-3-7-10-9;1-4-8-7(9-5-1)3-2-6-10-8;1-3-7-4-2-6-10-8(7)9-5-1;1-2-7-6-10-5-3-8(7)9-4-1;1-2-7-3-5-10-6-8(7)9-4-1;1-3-7-4-2-6-9-8(7)5-1;1-2-7-6(8-4-1)3-5-9-7;1-2-6-3-5-9-7(6)8-4-1;1-2-6-4-9-5-7(6)8-3-1/h3,5,7H,1-2,4,6H2;1-7H;1,4-5H,2-3,6H2;1,3,5H,2,4,6H2;2*1-2,4H,3,5-6H2;2,4,6H,1,3,5H2;3*1-5H
• InChIKey: HZHCLPZSOHLZJU-UHFFFAOYSA-N
• XLogP: 17.78
• TPSA: 165.82 Ų
• H-Bond Acceptors: 17
• Heavy Atoms: 96
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1327.76
LogP ≤ 5	17.78
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-5H-cyclopenta[b]pyridine;3,4-dihydro-2H-pyrano[2,3-b]pyridine;3,4-dihydro-2H-pyrano[3,2-b]pyridine;6,8-dihydro-5H-pyrano[3,4-b]pyridine;7,8-dihydro-5H-pyrano[4,3-b]pyridine;quinoline;5,6,7,8-tetrahydroquinoline;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[3,4-b]pyridine?

The IUPAC name of 6,7-dihydro-5H-cyclopenta[b]pyridine;3,4-dihydro-2H-pyrano[2,3-b]pyridine;3,4-dihydro-2H-pyrano[3,2-b]pyridine;6,8-dihydro-5H-pyrano[3,4-b]pyridine;7,8-dihydro-5H-pyrano[4,3-b]pyridine;quinoline;5,6,7,8-tetrahydroquinoline;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[3,4-b]pyridine (CID 158631805) is 6,7-dihydro-5H-cyclopenta[b]pyridine;3,4-dihydro-2H-pyrano[2,3-b]pyridine;3,4-dihydro-2H-pyrano[3,2-b]pyridine;6,8-dihydro-5H-pyrano[3,4-b]pyridine;7,8-dihydro-5H-pyrano[4,3-b]pyridine;quinoline;5,6,7,8-tetrahydroquinoline;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[3,4-b]pyridine.

What is the SMILES notation for 6,7-dihydro-5H-cyclopenta[b]pyridine;3,4-dihydro-2H-pyrano[2,3-b]pyridine;3,4-dihydro-2H-pyrano[3,2-b]pyridine;6,8-dihydro-5H-pyrano[3,4-b]pyridine;7,8-dihydro-5H-pyrano[4,3-b]pyridine;quinoline;5,6,7,8-tetrahydroquinoline;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[3,4-b]pyridine?

The canonical SMILES for 6,7-dihydro-5H-cyclopenta[b]pyridine;3,4-dihydro-2H-pyrano[2,3-b]pyridine;3,4-dihydro-2H-pyrano[3,2-b]pyridine;6,8-dihydro-5H-pyrano[3,4-b]pyridine;7,8-dihydro-5H-pyrano[4,3-b]pyridine;quinoline;5,6,7,8-tetrahydroquinoline;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[3,4-b]pyridine is c1ccc2ncccc2c1.c1cnc2c(c1)CCC2.c1cnc2c(c1)CCCC2.c1cnc2c(c1)CCCO2.c1cnc2c(c1)CCOC2.c1cnc2c(c1)COCC2.c1cnc2c(c1)OCCC2.c1cnc2ccsc2c1.c1cnc2cscc2c1.c1cnc2sccc2c1.

What is the InChIKey of 6,7-dihydro-5H-cyclopenta[b]pyridine;3,4-dihydro-2H-pyrano[2,3-b]pyridine;3,4-dihydro-2H-pyrano[3,2-b]pyridine;6,8-dihydro-5H-pyrano[3,4-b]pyridine;7,8-dihydro-5H-pyrano[4,3-b]pyridine;quinoline;5,6,7,8-tetrahydroquinoline;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[3,4-b]pyridine?

The InChIKey is HZHCLPZSOHLZJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N.C9H7N.4C8H9NO.C8H9N.3C7H5NS/c2*1-2-6-9-8(4-1)5-3-7-10-9;1-4-8-7(9-5-1)3-2-6-10-8;1-3-7-4-2-6-10-8(7)9-5-1;1-2-7-6-10-5-3-8(7)9-4-1;1-2-7-3-5-10-6-8(7)9-4-1;1-3-7-4-2-6-9-8(7)5-1;1-2-7-6(8-4-1)3-5-9-7;1-2-6-3-5-9-7(6)8-4-1;1-2-6-4-9-5-7(6)8-3-1/h3,5,7H,1-2,4,6H2;1-7H;1,4-5H,2-3,6H2;1,3,5H,2,4,6H2;2*1-2,4H,3,5-6H2;2,4,6H,1,3,5H2;3*1-5H.

What are the key properties of 6,7-dihydro-5H-cyclopenta[b]pyridine;3,4-dihydro-2H-pyrano[2,3-b]pyridine;3,4-dihydro-2H-pyrano[3,2-b]pyridine;6,8-dihydro-5H-pyrano[3,4-b]pyridine;7,8-dihydro-5H-pyrano[4,3-b]pyridine;quinoline;5,6,7,8-tetrahydroquinoline;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[3,4-b]pyridine?

6,7-dihydro-5H-cyclopenta[b]pyridine;3,4-dihydro-2H-pyrano[2,3-b]pyridine;3,4-dihydro-2H-pyrano[3,2-b]pyridine;6,8-dihydro-5H-pyrano[3,4-b]pyridine;7,8-dihydro-5H-pyrano[4,3-b]pyridine;quinoline;5,6,7,8-tetrahydroquinoline;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[3,4-b]pyridine has a molecular weight of 1327.76 g/mol, XLogP of 17.78, 0 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 6,7-dihydro-5H-cyclopenta[b]pyridine;3,4-dihydro-2H-pyrano[2,3-b]pyridine;3,4-dihydro-2H-pyrano[3,2-b]pyridine;6,8-dihydro-5H-pyrano[3,4-b]pyridine;7,8-dihydro-5H-pyrano[4,3-b]pyridine;quinoline;5,6,7,8-tetrahydroquinoline;thieno[2,3-b]pyridine;thieno[3,2-b]pyridine;thieno[3,4-b]pyridine is sourced from PubChem (CID 158631805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).