2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium

C6H7N2Y- — CID 58291708

IUPAC2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium
SMILES[2H]c1nc(C)[c-]c(C)n1.[Y]
InChIInChI=1S/C6H7N2.Y/c1-5-3-6(2)8-4-7-5;/h4H,1-2H3;/q-1;/i4D;
InChIKeyRRJQJFMTCPUGAW-BCVNIXSYSA-N
MW197.05 g/mol
LogP0.89
Rot. Bonds

About 2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium

2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium (PubChem CID 58291708) has the molecular formula C6H7N2Y- and a molecular weight of 197.05 g/mol. Its IUPAC name is 2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium.

Molecular Properties

Compound Name2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium
PubChem CID58291708
Molecular FormulaC6H7N2Y-
Molecular Weight197.05 g/mol
Exact Mass196.97
IUPAC Name2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium
SMILES[2H]c1nc(C)[c-]c(C)n1.[Y]
InChIInChI=1S/C6H7N2.Y/c1-5-3-6(2)8-4-7-5;/h4H,1-2H3;/q-1;/i4D;
InChIKeyRRJQJFMTCPUGAW-BCVNIXSYSA-N
XLogP0.89
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.05
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-deuterio-4,6-dimethyl-5H-pyrimidin-5-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

Related Compounds

lithium 4,6-dimethyl-5H-pyrimidin-5-ide
CID 134892315
4,5,6-trimethyl-2H-pyrimidin-2-ide;tetrakis(yttrium)
CID 58106162
4,6-dimethyl-5H-pyrimidin-5-id-2-amine;yttrium
CID 58291655
4,6-dimethyl-5H-pyrimidin-5-ide;yttrium
CID 58291684
Potassium;4,6-dimethyl-2,5-dihydropyrimidine-2,5-diide;yttrium
CID 58291691
2,4,6-trimethyl-5H-pyrimidin-5-ide;yttrium
CID 58630602
carbanide;2,4,6-trimethyl-5H-pyrimidin-5-ide;yttrium
CID 58651175
4,6-dimethyl-2H-pyrimidin-2-ide;yttrium
CID 58945782
4,6-Dimethyl-2,5-dihydropyrimidine-2,5-diide;tungsten;yttrium
CID 59389610
4,6-dimethyl-2H-pyrimidin-2-id-5-amine;yttrium
CID 59467478
4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium
CID 60010076
2-ethyl-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium
CID 145576947

Frequently Asked Questions

What is the IUPAC name of 2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium?
The IUPAC name of 2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium (CID 58291708) is 2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium.
What is the SMILES notation for 2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium?
The canonical SMILES for 2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium is [2H]c1nc(C)[c-]c(C)n1.[Y].
What is the InChIKey of 2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium?
The InChIKey is RRJQJFMTCPUGAW-BCVNIXSYSA-N. The full InChI is InChI=1S/C6H7N2.Y/c1-5-3-6(2)8-4-7-5;/h4H,1-2H3;/q-1;/i4D;.
What are the key properties of 2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium?
2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium has a molecular weight of 197.05 g/mol, XLogP of 0.89, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium is sourced from PubChem (CID 58291708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).