ethane;4-methyl-2H-pyrimidin-2-ide;yttrium

C7H11N2Y- — CID 159180056

IUPACethane;4-methyl-2H-pyrimidin-2-ide;yttrium
SMILESCC.Cc1ccn[c-]n1.[Y]
InChIInChI=1S/C5H5N2.C2H6.Y/c1-5-2-3-6-4-7-5;1-2;/h2-3H,1H3;1-2H3;/q-1;;
InChIKeyRZZOAVUYKXRXNR-UHFFFAOYSA-N
MW212.09 g/mol
LogP1.61
Rot. Bonds

About ethane;4-methyl-2H-pyrimidin-2-ide;yttrium

ethane;4-methyl-2H-pyrimidin-2-ide;yttrium (PubChem CID 159180056) has the molecular formula C7H11N2Y- and a molecular weight of 212.09 g/mol. Its IUPAC name is ethane;4-methyl-2H-pyrimidin-2-ide;yttrium.

Molecular Properties

Compound Nameethane;4-methyl-2H-pyrimidin-2-ide;yttrium
PubChem CID159180056
Molecular FormulaC7H11N2Y-
Molecular Weight212.09 g/mol
Exact Mass212.00
IUPAC Nameethane;4-methyl-2H-pyrimidin-2-ide;yttrium
SMILESCC.Cc1ccn[c-]n1.[Y]
InChIInChI=1S/C5H5N2.C2H6.Y/c1-5-2-3-6-4-7-5;1-2;/h2-3H,1H3;1-2H3;/q-1;;
InChIKeyRZZOAVUYKXRXNR-UHFFFAOYSA-N
XLogP1.61
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.09
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze ethane;4-methyl-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 ethane;4-methyl-2H-pyrimidin-2-ide;yttrium?
The IUPAC name of ethane;4-methyl-2H-pyrimidin-2-ide;yttrium (CID 159180056) is ethane;4-methyl-2H-pyrimidin-2-ide;yttrium.
What is the SMILES notation for ethane;4-methyl-2H-pyrimidin-2-ide;yttrium?
The canonical SMILES for ethane;4-methyl-2H-pyrimidin-2-ide;yttrium is CC.Cc1ccn[c-]n1.[Y].
What is the InChIKey of ethane;4-methyl-2H-pyrimidin-2-ide;yttrium?
The InChIKey is RZZOAVUYKXRXNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N2.C2H6.Y/c1-5-2-3-6-4-7-5;1-2;/h2-3H,1H3;1-2H3;/q-1;;.
What are the key properties of ethane;4-methyl-2H-pyrimidin-2-ide;yttrium?
ethane;4-methyl-2H-pyrimidin-2-ide;yttrium has a molecular weight of 212.09 g/mol, XLogP of 1.61, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methyl-2H-pyrimidin-2-ide;yttrium is sourced from PubChem (CID 159180056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).