3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium)

C8H9NY2-2 — CID 59961972

IUPAC3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium)
SMILESCc1[c-]n[c-]c(C)c1C.[Y].[Y]
InChIInChI=1S/C8H9N.2Y/c1-6-4-9-5-7(2)8(6)3;;/h1-3H3;;/q-2;;
InChIKeyGTWGEIZWLVONAI-UHFFFAOYSA-N
MW296.98 g/mol
LogP1.60
Rot. Bonds

About 3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium)

3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium) (PubChem CID 59961972) has the molecular formula C8H9NY2-2 and a molecular weight of 296.98 g/mol. Its IUPAC name is 3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium).

Molecular Properties

Compound Name3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium)
PubChem CID59961972
Molecular FormulaC8H9NY2-2
Molecular Weight296.98 g/mol
Exact Mass296.89
IUPAC Name3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium)
SMILESCc1[c-]n[c-]c(C)c1C.[Y].[Y]
InChIInChI=1S/C8H9N.2Y/c1-6-4-9-5-7(2)8(6)3;;/h1-3H3;;/q-2;;
InChIKeyGTWGEIZWLVONAI-UHFFFAOYSA-N
XLogP1.60
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.98
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium)?
The IUPAC name of 3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium) (CID 59961972) is 3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium).
What is the SMILES notation for 3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium)?
The canonical SMILES for 3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium) is Cc1[c-]n[c-]c(C)c1C.[Y].[Y].
What is the InChIKey of 3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium)?
The InChIKey is GTWGEIZWLVONAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N.2Y/c1-6-4-9-5-7(2)8(6)3;;/h1-3H3;;/q-2;;.
What are the key properties of 3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium)?
3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium) has a molecular weight of 296.98 g/mol, XLogP of 1.60, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5-trimethyl-2,6-dihydropyridine-2,6-diide;bis(yttrium) is sourced from PubChem (CID 59961972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).