bis(7-methyl-2H-1,5-naphthyridin-2-ide);7-methyl-2H-1,6-naphthyridin-2-ide;7-methyl-2H-1,8-naphthyridin-2-ide;7-methyl-2H-quinazolin-2-ide;7-methyl-2H-quinolin-2-ide;bis(7-methyl-2H-quinoxalin-2-ide);propane;octakis(yttrium)

C97H113N15Y8-16 — CID 157462830

About bis(7-methyl-2H-1,5-naphthyridin-2-ide);7-methyl-2H-1,6-naphthyridin-2-ide;7-methyl-2H-1,8-naphthyridin-2-ide;7-methyl-2H-quinazolin-2-ide;7-methyl-2H-quinolin-2-ide;bis(7-methyl-2H-quinoxalin-2-ide);propane;octakis(yttrium)

bis(7-methyl-2H-1,5-naphthyridin-2-ide);7-methyl-2H-1,6-naphthyridin-2-ide;7-methyl-2H-1,8-naphthyridin-2-ide;7-methyl-2H-quinazolin-2-ide;7-methyl-2H-quinolin-2-ide;bis(7-methyl-2H-quinoxalin-2-ide);propane;octakis(yttrium) (PubChem CID 157462830) has the molecular formula C97H113N15Y8-16 and a molecular weight of 2200.32 g/mol. Its IUPAC name is bis(7-methyl-2H-1,5-naphthyridin-2-ide);7-methyl-2H-1,6-naphthyridin-2-ide;7-methyl-2H-1,8-naphthyridin-2-ide;7-methyl-2H-quinazolin-2-ide;7-methyl-2H-quinolin-2-ide;bis(7-methyl-2H-quinoxalin-2-ide);propane;octakis(yttrium).

Molecular Properties

• Compound Name: bis(7-methyl-2H-1,5-naphthyridin-2-ide);7-methyl-2H-1,6-naphthyridin-2-ide;7-methyl-2H-1,8-naphthyridin-2-ide;7-methyl-2H-quinazolin-2-ide;7-methyl-2H-quinolin-2-ide;bis(7-methyl-2H-quinoxalin-2-ide);propane;octakis(yttrium)
• PubChem CID: 157462830
• Molecular Formula: C97H113N15Y8-16
• Molecular Weight: 2200.32 g/mol
• Exact Mass: 2199.19
• IUPAC Name: bis(7-methyl-2H-1,5-naphthyridin-2-ide);7-methyl-2H-1,6-naphthyridin-2-ide;7-methyl-2H-1,8-naphthyridin-2-ide;7-methyl-2H-quinazolin-2-ide;7-methyl-2H-quinolin-2-ide;bis(7-methyl-2H-quinoxalin-2-ide);propane;octakis(yttrium)
• SMILES: C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.Cc1cc2n[c-]ccc2cn1.Cc1ccc2cc[c-]nc2c1.Cc1ccc2cc[c-]nc2n1.Cc1ccc2cn[c-]nc2c1.Cc1ccc2nc[c-]nc2c1.Cc1ccc2nc[c-]nc2c1.Cc1cnc2cc[c-]nc2c1.Cc1cnc2cc[c-]nc2c1.[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y]
• InChI: InChI=1S/C10H8N.7C9H7N2.8C3H7.8Y/c1-8-4-5-9-3-2-6-11-10(9)7-8;1-7-2-3-8-5-10-6-11-9(8)4-7;2*1-7-2-3-8-9(6-7)11-5-4-10-8;1-7-4-5-8-3-2-6-10-9(8)11-7;1-7-5-9-8(6-11-7)3-2-4-10-9;2*1-7-5-9-8(11-6-7)3-2-4-10-9;8*1-3-2;;;;;;;;/h2-5,7H,1H3;2-5H,1H3;2*2-4,6H,1H3;2-5H,1H3;3*2-3,5-6H,1H3;8*3H,1-2H3;;;;;;;;/q16*-1
• InChIKey: PTAIBTZGYZDWCR-UHFFFAOYSA-N
• XLogP: 24.34
• TPSA: 193.35 Ų
• H-Bond Acceptors: 15
• Heavy Atoms: 120
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2200.32
LogP ≤ 5	24.34
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(7-methyl-2H-1,5-naphthyridin-2-ide);7-methyl-2H-1,6-naphthyridin-2-ide;7-methyl-2H-1,8-naphthyridin-2-ide;7-methyl-2H-quinazolin-2-ide;7-methyl-2H-quinolin-2-ide;bis(7-methyl-2H-quinoxalin-2-ide);propane;octakis(yttrium)?

The IUPAC name of bis(7-methyl-2H-1,5-naphthyridin-2-ide);7-methyl-2H-1,6-naphthyridin-2-ide;7-methyl-2H-1,8-naphthyridin-2-ide;7-methyl-2H-quinazolin-2-ide;7-methyl-2H-quinolin-2-ide;bis(7-methyl-2H-quinoxalin-2-ide);propane;octakis(yttrium) (CID 157462830) is bis(7-methyl-2H-1,5-naphthyridin-2-ide);7-methyl-2H-1,6-naphthyridin-2-ide;7-methyl-2H-1,8-naphthyridin-2-ide;7-methyl-2H-quinazolin-2-ide;7-methyl-2H-quinolin-2-ide;bis(7-methyl-2H-quinoxalin-2-ide);propane;octakis(yttrium).

What is the SMILES notation for bis(7-methyl-2H-1,5-naphthyridin-2-ide);7-methyl-2H-1,6-naphthyridin-2-ide;7-methyl-2H-1,8-naphthyridin-2-ide;7-methyl-2H-quinazolin-2-ide;7-methyl-2H-quinolin-2-ide;bis(7-methyl-2H-quinoxalin-2-ide);propane;octakis(yttrium)?

The canonical SMILES for bis(7-methyl-2H-1,5-naphthyridin-2-ide);7-methyl-2H-1,6-naphthyridin-2-ide;7-methyl-2H-1,8-naphthyridin-2-ide;7-methyl-2H-quinazolin-2-ide;7-methyl-2H-quinolin-2-ide;bis(7-methyl-2H-quinoxalin-2-ide);propane;octakis(yttrium) is C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.Cc1cc2n[c-]ccc2cn1.Cc1ccc2cc[c-]nc2c1.Cc1ccc2cc[c-]nc2n1.Cc1ccc2cn[c-]nc2c1.Cc1ccc2nc[c-]nc2c1.Cc1ccc2nc[c-]nc2c1.Cc1cnc2cc[c-]nc2c1.Cc1cnc2cc[c-]nc2c1.[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].

What is the InChIKey of bis(7-methyl-2H-1,5-naphthyridin-2-ide);7-methyl-2H-1,6-naphthyridin-2-ide;7-methyl-2H-1,8-naphthyridin-2-ide;7-methyl-2H-quinazolin-2-ide;7-methyl-2H-quinolin-2-ide;bis(7-methyl-2H-quinoxalin-2-ide);propane;octakis(yttrium)?

The InChIKey is PTAIBTZGYZDWCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N.7C9H7N2.8C3H7.8Y/c1-8-4-5-9-3-2-6-11-10(9)7-8;1-7-2-3-8-5-10-6-11-9(8)4-7;2*1-7-2-3-8-9(6-7)11-5-4-10-8;1-7-4-5-8-3-2-6-10-9(8)11-7;1-7-5-9-8(6-11-7)3-2-4-10-9;2*1-7-5-9-8(11-6-7)3-2-4-10-9;8*1-3-2;;;;;;;;/h2-5,7H,1H3;2-5H,1H3;2*2-4,6H,1H3;2-5H,1H3;3*2-3,5-6H,1H3;8*3H,1-2H3;;;;;;;;/q16*-1;;;;;;;;.

What are the key properties of bis(7-methyl-2H-1,5-naphthyridin-2-ide);7-methyl-2H-1,6-naphthyridin-2-ide;7-methyl-2H-1,8-naphthyridin-2-ide;7-methyl-2H-quinazolin-2-ide;7-methyl-2H-quinolin-2-ide;bis(7-methyl-2H-quinoxalin-2-ide);propane;octakis(yttrium)?

bis(7-methyl-2H-1,5-naphthyridin-2-ide);7-methyl-2H-1,6-naphthyridin-2-ide;7-methyl-2H-1,8-naphthyridin-2-ide;7-methyl-2H-quinazolin-2-ide;7-methyl-2H-quinolin-2-ide;bis(7-methyl-2H-quinoxalin-2-ide);propane;octakis(yttrium) has a molecular weight of 2200.32 g/mol, XLogP of 24.34, 0 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for bis(7-methyl-2H-1,5-naphthyridin-2-ide);7-methyl-2H-1,6-naphthyridin-2-ide;7-methyl-2H-1,8-naphthyridin-2-ide;7-methyl-2H-quinazolin-2-ide;7-methyl-2H-quinolin-2-ide;bis(7-methyl-2H-quinoxalin-2-ide);propane;octakis(yttrium) is sourced from PubChem (CID 157462830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).