carbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium

C8H12N2Y-2 — CID 58651167

IUPACcarbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium
SMILESCc1n[c-]nc(C)c1C.[CH3-].[Y]
InChIInChI=1S/C7H9N2.CH3.Y/c1-5-6(2)8-4-9-7(5)3;;/h1-3H3;1H3;/q2*-1;
InChIKeyXIIMWLHUGXDLLT-UHFFFAOYSA-N
MW225.10 g/mol
LogP1.65
Rot. Bonds

About carbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium

carbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium (PubChem CID 58651167) has the molecular formula C8H12N2Y-2 and a molecular weight of 225.10 g/mol. Its IUPAC name is carbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium.

Molecular Properties

Compound Namecarbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium
PubChem CID58651167
Molecular FormulaC8H12N2Y-2
Molecular Weight225.10 g/mol
Exact Mass225.01
IUPAC Namecarbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium
SMILESCc1n[c-]nc(C)c1C.[CH3-].[Y]
InChIInChI=1S/C7H9N2.CH3.Y/c1-5-6(2)8-4-9-7(5)3;;/h1-3H3;1H3;/q2*-1;
InChIKeyXIIMWLHUGXDLLT-UHFFFAOYSA-N
XLogP1.65
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.10
LogP ≤ 51.65
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 carbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium?
The IUPAC name of carbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium (CID 58651167) is carbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium.
What is the SMILES notation for carbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium?
The canonical SMILES for carbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium is Cc1n[c-]nc(C)c1C.[CH3-].[Y].
What is the InChIKey of carbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium?
The InChIKey is XIIMWLHUGXDLLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N2.CH3.Y/c1-5-6(2)8-4-9-7(5)3;;/h1-3H3;1H3;/q2*-1;.
What are the key properties of carbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium?
carbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium has a molecular weight of 225.10 g/mol, XLogP of 1.65, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium is sourced from PubChem (CID 58651167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).