2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium)

C5H4N2Y4-2 — CID 162087804

IUPAC2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium)
SMILESCc1n[c-]c[c-]n1.[Y].[Y].[Y].[Y]
InChIInChI=1S/C5H4N2.4Y/c1-5-6-3-2-4-7-5;;;;/h2H,1H3;;;;/q-2;;;;
InChIKeyFWIOEPGGANNPSZ-UHFFFAOYSA-N
MW447.73 g/mol
LogP0.38
Rot. Bonds

About 2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium)

2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium) (PubChem CID 162087804) has the molecular formula C5H4N2Y4-2 and a molecular weight of 447.73 g/mol. Its IUPAC name is 2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium).

Molecular Properties

Compound Name2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium)
PubChem CID162087804
Molecular FormulaC5H4N2Y4-2
Molecular Weight447.73 g/mol
Exact Mass447.66
IUPAC Name2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium)
SMILESCc1n[c-]c[c-]n1.[Y].[Y].[Y].[Y]
InChIInChI=1S/C5H4N2.4Y/c1-5-6-3-2-4-7-5;;;;/h2H,1H3;;;;/q-2;;;;
InChIKeyFWIOEPGGANNPSZ-UHFFFAOYSA-N
XLogP0.38
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.73
LogP ≤ 50.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium)?
The IUPAC name of 2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium) (CID 162087804) is 2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium).
What is the SMILES notation for 2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium)?
The canonical SMILES for 2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium) is Cc1n[c-]c[c-]n1.[Y].[Y].[Y].[Y].
What is the InChIKey of 2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium)?
The InChIKey is FWIOEPGGANNPSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4N2.4Y/c1-5-6-3-2-4-7-5;;;;/h2H,1H3;;;;/q-2;;;;.
What are the key properties of 2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium)?
2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium) has a molecular weight of 447.73 g/mol, XLogP of 0.38, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4,6-dihydropyrimidine-4,6-diide;tetrakis(yttrium) is sourced from PubChem (CID 162087804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).