ethane;2-(3H-quinolin-3-id-4-yl)-3H-quinolin-3-ide;2-(6H-quinolin-6-id-5-yl)-3H-quinolin-3-ide;2-(7H-quinolin-7-id-8-yl)-3H-quinolin-3-ide;3-(6H-quinolin-6-id-5-yl)-2H-quinolin-2-ide;3-(7H-quinolin-7-id-8-yl)-2H-quinolin-2-ide;4-(7H-quinolin-7-id-6-yl)-3H-quinolin-3-ide;5-(7H-quinolin-7-id-6-yl)-6H-quinolin-6-ide;6-(7H-quinolin-7-id-8-yl)-7H-quinolin-7-ide;octakis(yttrium)

C176H176N16Y8-16 — CID 158074268

About ethane;2-(3H-quinolin-3-id-4-yl)-3H-quinolin-3-ide;2-(6H-quinolin-6-id-5-yl)-3H-quinolin-3-ide;2-(7H-quinolin-7-id-8-yl)-3H-quinolin-3-ide;3-(6H-quinolin-6-id-5-yl)-2H-quinolin-2-ide;3-(7H-quinolin-7-id-8-yl)-2H-quinolin-2-ide;4-(7H-quinolin-7-id-6-yl)-3H-quinolin-3-ide;5-(7H-quinolin-7-id-6-yl)-6H-quinolin-6-ide;6-(7H-quinolin-7-id-8-yl)-7H-quinolin-7-ide;octakis(yttrium)

ethane;2-(3H-quinolin-3-id-4-yl)-3H-quinolin-3-ide;2-(6H-quinolin-6-id-5-yl)-3H-quinolin-3-ide;2-(7H-quinolin-7-id-8-yl)-3H-quinolin-3-ide;3-(6H-quinolin-6-id-5-yl)-2H-quinolin-2-ide;3-(7H-quinolin-7-id-8-yl)-2H-quinolin-2-ide;4-(7H-quinolin-7-id-6-yl)-3H-quinolin-3-ide;5-(7H-quinolin-7-id-6-yl)-6H-quinolin-6-ide;6-(7H-quinolin-7-id-8-yl)-7H-quinolin-7-ide;octakis(yttrium) (PubChem CID 158074268) has the molecular formula C176H176N16Y8-16 and a molecular weight of 3226.70 g/mol. Its IUPAC name is ethane;2-(3H-quinolin-3-id-4-yl)-3H-quinolin-3-ide;2-(6H-quinolin-6-id-5-yl)-3H-quinolin-3-ide;2-(7H-quinolin-7-id-8-yl)-3H-quinolin-3-ide;3-(6H-quinolin-6-id-5-yl)-2H-quinolin-2-ide;3-(7H-quinolin-7-id-8-yl)-2H-quinolin-2-ide;4-(7H-quinolin-7-id-6-yl)-3H-quinolin-3-ide;5-(7H-quinolin-7-id-6-yl)-6H-quinolin-6-ide;6-(7H-quinolin-7-id-8-yl)-7H-quinolin-7-ide;octakis(yttrium).

Molecular Properties

• Compound Name: ethane;2-(3H-quinolin-3-id-4-yl)-3H-quinolin-3-ide;2-(6H-quinolin-6-id-5-yl)-3H-quinolin-3-ide;2-(7H-quinolin-7-id-8-yl)-3H-quinolin-3-ide;3-(6H-quinolin-6-id-5-yl)-2H-quinolin-2-ide;3-(7H-quinolin-7-id-8-yl)-2H-quinolin-2-ide;4-(7H-quinolin-7-id-6-yl)-3H-quinolin-3-ide;5-(7H-quinolin-7-id-6-yl)-6H-quinolin-6-ide;6-(7H-quinolin-7-id-8-yl)-7H-quinolin-7-ide;octakis(yttrium)
• PubChem CID: 158074268
• Molecular Formula: C176H176N16Y8-16
• Molecular Weight: 3226.70 g/mol
• Exact Mass: 3224.68
• IUPAC Name: ethane;2-(3H-quinolin-3-id-4-yl)-3H-quinolin-3-ide;2-(6H-quinolin-6-id-5-yl)-3H-quinolin-3-ide;2-(7H-quinolin-7-id-8-yl)-3H-quinolin-3-ide;3-(6H-quinolin-6-id-5-yl)-2H-quinolin-2-ide;3-(7H-quinolin-7-id-8-yl)-2H-quinolin-2-ide;4-(7H-quinolin-7-id-6-yl)-3H-quinolin-3-ide;5-(7H-quinolin-7-id-6-yl)-6H-quinolin-6-ide;6-(7H-quinolin-7-id-8-yl)-7H-quinolin-7-ide;octakis(yttrium)
• SMILES: CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[c-]1cc2ccccc2nc1-c1[c-]ccc2cccnc12.[c-]1cc2ccccc2nc1-c1[c-]ccc2ncccc12.[c-]1cc2ccccc2nc1-c1[c-]cnc2ccccc12.[c-]1cc2ncccc2cc1-c1[c-]ccc2cccnc12.[c-]1cc2ncccc2cc1-c1[c-]ccc2ncccc12.[c-]1cc2ncccc2cc1-c1[c-]cnc2ccccc12.[c-]1nc2ccccc2cc1-c1[c-]ccc2cccnc12.[c-]1nc2ccccc2cc1-c1[c-]ccc2ncccc12
• InChI: InChI=1S/8C18H10N2.16C2H6.8Y/c1-5-15(16-6-3-11-20-18(16)7-1)13-8-9-17-14(12-13)4-2-10-19-17;1-4-13-5-2-11-20-18(13)16(7-1)14-8-9-17-15(12-14)6-3-10-19-17;1-3-7-16-13(5-1)9-10-18(20-16)15-11-12-19-17-8-4-2-6-14(15)17;1-2-9-16-13(5-1)10-11-17(20-16)15-8-3-6-14-7-4-12-19-18(14)15;1-2-9-17-14(5-1)11-15(12-20-17)16-8-3-6-13-7-4-10-19-18(13)16;1-2-8-16-13(5-1)10-11-18(20-16)15-6-3-9-17-14(15)7-4-12-19-17;1-2-8-17-13(5-1)11-14(12-20-17)15-6-3-9-18-16(15)7-4-10-19-18;1-2-6-18-16(5-1)15(9-11-20-18)13-7-8-17-14(12-13)4-3-10-19-17;16*1-2;;;;;;;;/h1-4,6-7,9-12H;1-6,9-12H;1-9,12H;1-7,9-10,12H;1-7,9-11H;1-5,7-10,12H;1-5,7-11H;1-6,8,10-12H;16*1-2H3;;;;;;;;/q8*-2
• InChIKey: SJDWUFORLNNNQK-UHFFFAOYSA-N
• XLogP: 48.80
• TPSA: 206.24 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 8
• Heavy Atoms: 200
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3226.70
LogP ≤ 5	48.80
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of ethane;2-(3H-quinolin-3-id-4-yl)-3H-quinolin-3-ide;2-(6H-quinolin-6-id-5-yl)-3H-quinolin-3-ide;2-(7H-quinolin-7-id-8-yl)-3H-quinolin-3-ide;3-(6H-quinolin-6-id-5-yl)-2H-quinolin-2-ide;3-(7H-quinolin-7-id-8-yl)-2H-quinolin-2-ide;4-(7H-quinolin-7-id-6-yl)-3H-quinolin-3-ide;5-(7H-quinolin-7-id-6-yl)-6H-quinolin-6-ide;6-(7H-quinolin-7-id-8-yl)-7H-quinolin-7-ide;octakis(yttrium)?

The IUPAC name of ethane;2-(3H-quinolin-3-id-4-yl)-3H-quinolin-3-ide;2-(6H-quinolin-6-id-5-yl)-3H-quinolin-3-ide;2-(7H-quinolin-7-id-8-yl)-3H-quinolin-3-ide;3-(6H-quinolin-6-id-5-yl)-2H-quinolin-2-ide;3-(7H-quinolin-7-id-8-yl)-2H-quinolin-2-ide;4-(7H-quinolin-7-id-6-yl)-3H-quinolin-3-ide;5-(7H-quinolin-7-id-6-yl)-6H-quinolin-6-ide;6-(7H-quinolin-7-id-8-yl)-7H-quinolin-7-ide;octakis(yttrium) (CID 158074268) is ethane;2-(3H-quinolin-3-id-4-yl)-3H-quinolin-3-ide;2-(6H-quinolin-6-id-5-yl)-3H-quinolin-3-ide;2-(7H-quinolin-7-id-8-yl)-3H-quinolin-3-ide;3-(6H-quinolin-6-id-5-yl)-2H-quinolin-2-ide;3-(7H-quinolin-7-id-8-yl)-2H-quinolin-2-ide;4-(7H-quinolin-7-id-6-yl)-3H-quinolin-3-ide;5-(7H-quinolin-7-id-6-yl)-6H-quinolin-6-ide;6-(7H-quinolin-7-id-8-yl)-7H-quinolin-7-ide;octakis(yttrium).

What is the SMILES notation for ethane;2-(3H-quinolin-3-id-4-yl)-3H-quinolin-3-ide;2-(6H-quinolin-6-id-5-yl)-3H-quinolin-3-ide;2-(7H-quinolin-7-id-8-yl)-3H-quinolin-3-ide;3-(6H-quinolin-6-id-5-yl)-2H-quinolin-2-ide;3-(7H-quinolin-7-id-8-yl)-2H-quinolin-2-ide;4-(7H-quinolin-7-id-6-yl)-3H-quinolin-3-ide;5-(7H-quinolin-7-id-6-yl)-6H-quinolin-6-ide;6-(7H-quinolin-7-id-8-yl)-7H-quinolin-7-ide;octakis(yttrium)?

The canonical SMILES for ethane;2-(3H-quinolin-3-id-4-yl)-3H-quinolin-3-ide;2-(6H-quinolin-6-id-5-yl)-3H-quinolin-3-ide;2-(7H-quinolin-7-id-8-yl)-3H-quinolin-3-ide;3-(6H-quinolin-6-id-5-yl)-2H-quinolin-2-ide;3-(7H-quinolin-7-id-8-yl)-2H-quinolin-2-ide;4-(7H-quinolin-7-id-6-yl)-3H-quinolin-3-ide;5-(7H-quinolin-7-id-6-yl)-6H-quinolin-6-ide;6-(7H-quinolin-7-id-8-yl)-7H-quinolin-7-ide;octakis(yttrium) is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[c-]1cc2ccccc2nc1-c1[c-]ccc2cccnc12.[c-]1cc2ccccc2nc1-c1[c-]ccc2ncccc12.[c-]1cc2ccccc2nc1-c1[c-]cnc2ccccc12.[c-]1cc2ncccc2cc1-c1[c-]ccc2cccnc12.[c-]1cc2ncccc2cc1-c1[c-]ccc2ncccc12.[c-]1cc2ncccc2cc1-c1[c-]cnc2ccccc12.[c-]1nc2ccccc2cc1-c1[c-]ccc2cccnc12.[c-]1nc2ccccc2cc1-c1[c-]ccc2ncccc12.

What is the InChIKey of ethane;2-(3H-quinolin-3-id-4-yl)-3H-quinolin-3-ide;2-(6H-quinolin-6-id-5-yl)-3H-quinolin-3-ide;2-(7H-quinolin-7-id-8-yl)-3H-quinolin-3-ide;3-(6H-quinolin-6-id-5-yl)-2H-quinolin-2-ide;3-(7H-quinolin-7-id-8-yl)-2H-quinolin-2-ide;4-(7H-quinolin-7-id-6-yl)-3H-quinolin-3-ide;5-(7H-quinolin-7-id-6-yl)-6H-quinolin-6-ide;6-(7H-quinolin-7-id-8-yl)-7H-quinolin-7-ide;octakis(yttrium)?

The InChIKey is SJDWUFORLNNNQK-UHFFFAOYSA-N. The full InChI is InChI=1S/8C18H10N2.16C2H6.8Y/c1-5-15(16-6-3-11-20-18(16)7-1)13-8-9-17-14(12-13)4-2-10-19-17;1-4-13-5-2-11-20-18(13)16(7-1)14-8-9-17-15(12-14)6-3-10-19-17;1-3-7-16-13(5-1)9-10-18(20-16)15-11-12-19-17-8-4-2-6-14(15)17;1-2-9-16-13(5-1)10-11-17(20-16)15-8-3-6-14-7-4-12-19-18(14)15;1-2-9-17-14(5-1)11-15(12-20-17)16-8-3-6-13-7-4-10-19-18(13)16;1-2-8-16-13(5-1)10-11-18(20-16)15-6-3-9-17-14(15)7-4-12-19-17;1-2-8-17-13(5-1)11-14(12-20-17)15-6-3-9-18-16(15)7-4-10-19-18;1-2-6-18-16(5-1)15(9-11-20-18)13-7-8-17-14(12-13)4-3-10-19-17;16*1-2;;;;;;;;/h1-4,6-7,9-12H;1-6,9-12H;1-9,12H;1-7,9-10,12H;1-7,9-11H;1-5,7-10,12H;1-5,7-11H;1-6,8,10-12H;16*1-2H3;;;;;;;;/q8*-2;;;;;;;;;;;;;;;;;;;;;;;;.

What are the key properties of ethane;2-(3H-quinolin-3-id-4-yl)-3H-quinolin-3-ide;2-(6H-quinolin-6-id-5-yl)-3H-quinolin-3-ide;2-(7H-quinolin-7-id-8-yl)-3H-quinolin-3-ide;3-(6H-quinolin-6-id-5-yl)-2H-quinolin-2-ide;3-(7H-quinolin-7-id-8-yl)-2H-quinolin-2-ide;4-(7H-quinolin-7-id-6-yl)-3H-quinolin-3-ide;5-(7H-quinolin-7-id-6-yl)-6H-quinolin-6-ide;6-(7H-quinolin-7-id-8-yl)-7H-quinolin-7-ide;octakis(yttrium)?

ethane;2-(3H-quinolin-3-id-4-yl)-3H-quinolin-3-ide;2-(6H-quinolin-6-id-5-yl)-3H-quinolin-3-ide;2-(7H-quinolin-7-id-8-yl)-3H-quinolin-3-ide;3-(6H-quinolin-6-id-5-yl)-2H-quinolin-2-ide;3-(7H-quinolin-7-id-8-yl)-2H-quinolin-2-ide;4-(7H-quinolin-7-id-6-yl)-3H-quinolin-3-ide;5-(7H-quinolin-7-id-6-yl)-6H-quinolin-6-ide;6-(7H-quinolin-7-id-8-yl)-7H-quinolin-7-ide;octakis(yttrium) has a molecular weight of 3226.70 g/mol, XLogP of 48.80, 8 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for ethane;2-(3H-quinolin-3-id-4-yl)-3H-quinolin-3-ide;2-(6H-quinolin-6-id-5-yl)-3H-quinolin-3-ide;2-(7H-quinolin-7-id-8-yl)-3H-quinolin-3-ide;3-(6H-quinolin-6-id-5-yl)-2H-quinolin-2-ide;3-(7H-quinolin-7-id-8-yl)-2H-quinolin-2-ide;4-(7H-quinolin-7-id-6-yl)-3H-quinolin-3-ide;5-(7H-quinolin-7-id-6-yl)-6H-quinolin-6-ide;6-(7H-quinolin-7-id-8-yl)-7H-quinolin-7-ide;octakis(yttrium) is sourced from PubChem (CID 158074268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).