5-ethyl-2H-pyrimidin-2-ide;yttrium

C6H7N2Y- — CID 59968683

IUPAC5-ethyl-2H-pyrimidin-2-ide;yttrium
SMILESCCc1cn[c-]nc1.[Y]
InChIInChI=1S/C6H7N2.Y/c1-2-6-3-7-5-8-4-6;/h3-4H,2H2,1H3;/q-1;
InChIKeyBWHDYGPFDUWPBJ-UHFFFAOYSA-N
MW196.04 g/mol
LogP0.84
Rot. Bonds1

About 5-ethyl-2H-pyrimidin-2-ide;yttrium

5-ethyl-2H-pyrimidin-2-ide;yttrium (PubChem CID 59968683) has the molecular formula C6H7N2Y- and a molecular weight of 196.04 g/mol. Its IUPAC name is 5-ethyl-2H-pyrimidin-2-ide;yttrium.

Molecular Properties

Compound Name5-ethyl-2H-pyrimidin-2-ide;yttrium
PubChem CID59968683
Molecular FormulaC6H7N2Y-
Molecular Weight196.04 g/mol
Exact Mass195.97
IUPAC Name5-ethyl-2H-pyrimidin-2-ide;yttrium
SMILESCCc1cn[c-]nc1.[Y]
InChIInChI=1S/C6H7N2.Y/c1-2-6-3-7-5-8-4-6;/h3-4H,2H2,1H3;/q-1;
InChIKeyBWHDYGPFDUWPBJ-UHFFFAOYSA-N
XLogP0.84
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.04
LogP ≤ 50.84
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 5-ethyl-2H-pyrimidin-2-ide;yttrium?
The IUPAC name of 5-ethyl-2H-pyrimidin-2-ide;yttrium (CID 59968683) is 5-ethyl-2H-pyrimidin-2-ide;yttrium.
What is the SMILES notation for 5-ethyl-2H-pyrimidin-2-ide;yttrium?
The canonical SMILES for 5-ethyl-2H-pyrimidin-2-ide;yttrium is CCc1cn[c-]nc1.[Y].
What is the InChIKey of 5-ethyl-2H-pyrimidin-2-ide;yttrium?
The InChIKey is BWHDYGPFDUWPBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N2.Y/c1-2-6-3-7-5-8-4-6;/h3-4H,2H2,1H3;/q-1;.
What are the key properties of 5-ethyl-2H-pyrimidin-2-ide;yttrium?
5-ethyl-2H-pyrimidin-2-ide;yttrium has a molecular weight of 196.04 g/mol, XLogP of 0.84, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2H-pyrimidin-2-ide;yttrium is sourced from PubChem (CID 59968683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).