4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+)

C7H9N2Y+2 — CID 20800964

IUPAC4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+)
SMILESCc1n[c-]nc(C)c1C.[Y+3]
InChIInChI=1S/C7H9N2.Y/c1-5-6(2)8-4-9-7(5)3;/h1-3H3;/q-1;+3
InChIKeyFTRRHHSHLIYAGD-UHFFFAOYSA-N
MW210.07 g/mol
LogP1.20
Rot. Bonds

About 4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+)

4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+) (PubChem CID 20800964) has the molecular formula C7H9N2Y+2 and a molecular weight of 210.07 g/mol. Its IUPAC name is 4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+).

Molecular Properties

Compound Name4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+)
PubChem CID20800964
Molecular FormulaC7H9N2Y+2
Molecular Weight210.07 g/mol
Exact Mass209.98
IUPAC Name4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+)
SMILESCc1n[c-]nc(C)c1C.[Y+3]
InChIInChI=1S/C7H9N2.Y/c1-5-6(2)8-4-9-7(5)3;/h1-3H3;/q-1;+3
InChIKeyFTRRHHSHLIYAGD-UHFFFAOYSA-N
XLogP1.20
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.07
LogP ≤ 51.20
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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Related Compounds

5,6-Dimethyl-2,4-dihydropyrimidine-2,4-diide;bis(yttrium)
CID 57531787
4,5,6-trimethyl-2H-pyrimidin-2-ide;tetrakis(yttrium)
CID 58106162
5,6-Dimethyl-2,4-dihydropyrimidine-2,4-diide;hexakis(yttrium)
CID 58120789
4,6-dimethyl-5H-pyrimidin-5-id-2-amine;yttrium
CID 58291655
2,4-dimethyl-6-propyl-5H-pyrimidin-5-ide;yttrium
CID 58291678
4,6-dimethyl-5H-pyrimidin-5-ide;yttrium
CID 58291684
Potassium;4,6-dimethyl-2,5-dihydropyrimidine-2,5-diide;yttrium
CID 58291691
2-deuterio-4,6-dimethyl-5H-pyrimidin-5-ide;yttrium
CID 58291708
2,4,6-trimethyl-5H-pyrimidin-5-ide;yttrium
CID 58630602
carbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium
CID 58651167
carbanide;2,4,6-trimethyl-5H-pyrimidin-5-ide;yttrium
CID 58651175
carbanide;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium
CID 58651181

Frequently Asked Questions

What is the IUPAC name of 4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+)?
The IUPAC name of 4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+) (CID 20800964) is 4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+).
What is the SMILES notation for 4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+)?
The canonical SMILES for 4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+) is Cc1n[c-]nc(C)c1C.[Y+3].
What is the InChIKey of 4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+)?
The InChIKey is FTRRHHSHLIYAGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N2.Y/c1-5-6(2)8-4-9-7(5)3;/h1-3H3;/q-1;+3.
What are the key properties of 4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+)?
4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+) has a molecular weight of 210.07 g/mol, XLogP of 1.20, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium(3+) is sourced from PubChem (CID 20800964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).