5-propan-2-yl-2H-pyrimidin-2-ide;yttrium

C7H9N2Y- — CID 58041369

IUPAC5-propan-2-yl-2H-pyrimidin-2-ide;yttrium
SMILESCC(C)c1cn[c-]nc1.[Y]
InChIInChI=1S/C7H9N2.Y/c1-6(2)7-3-8-5-9-4-7;/h3-4,6H,1-2H3;/q-1;
InChIKeyHPZHVHJZGGJECY-UHFFFAOYSA-N
MW210.07 g/mol
LogP1.40
Rot. Bonds1

About 5-propan-2-yl-2H-pyrimidin-2-ide;yttrium

5-propan-2-yl-2H-pyrimidin-2-ide;yttrium (PubChem CID 58041369) has the molecular formula C7H9N2Y- and a molecular weight of 210.07 g/mol. Its IUPAC name is 5-propan-2-yl-2H-pyrimidin-2-ide;yttrium.

Molecular Properties

Compound Name5-propan-2-yl-2H-pyrimidin-2-ide;yttrium
PubChem CID58041369
Molecular FormulaC7H9N2Y-
Molecular Weight210.07 g/mol
Exact Mass209.98
IUPAC Name5-propan-2-yl-2H-pyrimidin-2-ide;yttrium
SMILESCC(C)c1cn[c-]nc1.[Y]
InChIInChI=1S/C7H9N2.Y/c1-6(2)7-3-8-5-9-4-7;/h3-4,6H,1-2H3;/q-1;
InChIKeyHPZHVHJZGGJECY-UHFFFAOYSA-N
XLogP1.40
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.07
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 5-propan-2-yl-2H-pyrimidin-2-ide;yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-2H-pyrimidin-2-ide;yttrium?
The IUPAC name of 5-propan-2-yl-2H-pyrimidin-2-ide;yttrium (CID 58041369) is 5-propan-2-yl-2H-pyrimidin-2-ide;yttrium.
What is the SMILES notation for 5-propan-2-yl-2H-pyrimidin-2-ide;yttrium?
The canonical SMILES for 5-propan-2-yl-2H-pyrimidin-2-ide;yttrium is CC(C)c1cn[c-]nc1.[Y].
What is the InChIKey of 5-propan-2-yl-2H-pyrimidin-2-ide;yttrium?
The InChIKey is HPZHVHJZGGJECY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N2.Y/c1-6(2)7-3-8-5-9-4-7;/h3-4,6H,1-2H3;/q-1;.
What are the key properties of 5-propan-2-yl-2H-pyrimidin-2-ide;yttrium?
5-propan-2-yl-2H-pyrimidin-2-ide;yttrium has a molecular weight of 210.07 g/mol, XLogP of 1.40, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-2H-pyrimidin-2-ide;yttrium is sourced from PubChem (CID 58041369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).