2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium

C5H3Cl2N2Y- — CID 58956286

IUPAC2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium
SMILESCc1[c-]nc(Cl)nc1Cl.[Y]
InChIInChI=1S/C5H3Cl2N2.Y/c1-3-2-8-5(7)9-4(3)6;/h1H3;/q-1;
InChIKeyWHZGSBVIRUMHOV-UHFFFAOYSA-N
MW250.91 g/mol
LogP1.89
Rot. Bonds

About 2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium

2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium (PubChem CID 58956286) has the molecular formula C5H3Cl2N2Y- and a molecular weight of 250.91 g/mol. Its IUPAC name is 2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium.

Molecular Properties

Compound Name2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium
PubChem CID58956286
Molecular FormulaC5H3Cl2N2Y-
Molecular Weight250.91 g/mol
Exact Mass249.87
IUPAC Name2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium
SMILESCc1[c-]nc(Cl)nc1Cl.[Y]
InChIInChI=1S/C5H3Cl2N2.Y/c1-3-2-8-5(7)9-4(3)6;/h1H3;/q-1;
InChIKeyWHZGSBVIRUMHOV-UHFFFAOYSA-N
XLogP1.89
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.91
LogP ≤ 51.89
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 2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium?
The IUPAC name of 2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium (CID 58956286) is 2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium.
What is the SMILES notation for 2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium?
The canonical SMILES for 2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium is Cc1[c-]nc(Cl)nc1Cl.[Y].
What is the InChIKey of 2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium?
The InChIKey is WHZGSBVIRUMHOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3Cl2N2.Y/c1-3-2-8-5(7)9-4(3)6;/h1H3;/q-1;.
What are the key properties of 2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium?
2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium has a molecular weight of 250.91 g/mol, XLogP of 1.89, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-5-methyl-4H-pyrimidin-4-ide;yttrium is sourced from PubChem (CID 58956286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).