2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium

C6H7N2Y- — CID 58291697

IUPAC2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium
SMILES[3H]c1[c-]c(C)nc(C)n1.[Y]
InChIInChI=1S/C6H7N2.Y/c1-5-3-4-7-6(2)8-5;/h4H,1-2H3;/q-1;/i4T;
InChIKeyLGSRXANBPXJTIR-BRGIFKCHSA-N
MW198.05 g/mol
LogP0.89
Rot. Bonds

About 2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium

2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium (PubChem CID 58291697) has the molecular formula C6H7N2Y- and a molecular weight of 198.05 g/mol. Its IUPAC name is 2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium.

Molecular Properties

Compound Name2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium
PubChem CID58291697
Molecular FormulaC6H7N2Y-
Molecular Weight198.05 g/mol
Exact Mass197.98
IUPAC Name2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium
SMILES[3H]c1[c-]c(C)nc(C)n1.[Y]
InChIInChI=1S/C6H7N2.Y/c1-5-3-4-7-6(2)8-5;/h4H,1-2H3;/q-1;/i4T;
InChIKeyLGSRXANBPXJTIR-BRGIFKCHSA-N
XLogP0.89
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.05
LogP ≤ 50.89
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 2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium?
The IUPAC name of 2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium (CID 58291697) is 2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium.
What is the SMILES notation for 2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium?
The canonical SMILES for 2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium is [3H]c1[c-]c(C)nc(C)n1.[Y].
What is the InChIKey of 2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium?
The InChIKey is LGSRXANBPXJTIR-BRGIFKCHSA-N. The full InChI is InChI=1S/C6H7N2.Y/c1-5-3-4-7-6(2)8-5;/h4H,1-2H3;/q-1;/i4T;.
What are the key properties of 2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium?
2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium has a molecular weight of 198.05 g/mol, XLogP of 0.89, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6-tritio-5H-pyrimidin-5-ide;yttrium is sourced from PubChem (CID 58291697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).