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

C6H7N2Y- — CID 58945782

IUPAC4,6-dimethyl-2H-pyrimidin-2-ide;yttrium
SMILESCc1cc(C)n[c-]n1.[Y]
InChIInChI=1S/C6H7N2.Y/c1-5-3-6(2)8-4-7-5;/h3H,1-2H3;/q-1;
InChIKeyDLTBJNMHDZVUAQ-UHFFFAOYSA-N
MW196.04 g/mol
LogP0.89
Rot. Bonds

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

4,6-dimethyl-2H-pyrimidin-2-ide;yttrium (PubChem CID 58945782) has the molecular formula C6H7N2Y- and a molecular weight of 196.04 g/mol. Its IUPAC name is 4,6-dimethyl-2H-pyrimidin-2-ide;yttrium.

Molecular Properties

Compound Name4,6-dimethyl-2H-pyrimidin-2-ide;yttrium
PubChem CID58945782
Molecular FormulaC6H7N2Y-
Molecular Weight196.04 g/mol
Exact Mass195.97
IUPAC Name4,6-dimethyl-2H-pyrimidin-2-ide;yttrium
SMILESCc1cc(C)n[c-]n1.[Y]
InChIInChI=1S/C6H7N2.Y/c1-5-3-6(2)8-4-7-5;/h3H,1-2H3;/q-1;
InChIKeyDLTBJNMHDZVUAQ-UHFFFAOYSA-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 ≤ 500196.04
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 4,6-dimethyl-2H-pyrimidin-2-ide;yttrium?
The IUPAC name of 4,6-dimethyl-2H-pyrimidin-2-ide;yttrium (CID 58945782) is 4,6-dimethyl-2H-pyrimidin-2-ide;yttrium.
What is the SMILES notation for 4,6-dimethyl-2H-pyrimidin-2-ide;yttrium?
The canonical SMILES for 4,6-dimethyl-2H-pyrimidin-2-ide;yttrium is Cc1cc(C)n[c-]n1.[Y].
What is the InChIKey of 4,6-dimethyl-2H-pyrimidin-2-ide;yttrium?
The InChIKey is DLTBJNMHDZVUAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N2.Y/c1-5-3-6(2)8-4-7-5;/h3H,1-2H3;/q-1;.
What are the key properties of 4,6-dimethyl-2H-pyrimidin-2-ide;yttrium?
4,6-dimethyl-2H-pyrimidin-2-ide;yttrium has a molecular weight of 196.04 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 4,6-dimethyl-2H-pyrimidin-2-ide;yttrium is sourced from PubChem (CID 58945782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).