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

C8H12N2Y+ — CID 21034538

IUPACcarbanide;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium(3+)
SMILESCc1n[c-]c(C)c(C)n1.[CH3-].[Y+3]
InChIInChI=1S/C7H9N2.CH3.Y/c1-5-4-8-7(3)9-6(5)2;;/h1-3H3;1H3;/q2*-1;+3
InChIKeyQMMHMVKBQBUOEQ-UHFFFAOYSA-N
MW225.10 g/mol
LogP1.65
Rot. Bonds

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

carbanide;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium(3+) (PubChem CID 21034538) has the molecular formula C8H12N2Y+ and a molecular weight of 225.10 g/mol. Its IUPAC name is carbanide;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium(3+).

Molecular Properties

Compound Namecarbanide;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium(3+)
PubChem CID21034538
Molecular FormulaC8H12N2Y+
Molecular Weight225.10 g/mol
Exact Mass225.01
IUPAC Namecarbanide;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium(3+)
SMILESCc1n[c-]c(C)c(C)n1.[CH3-].[Y+3]
InChIInChI=1S/C7H9N2.CH3.Y/c1-5-4-8-7(3)9-6(5)2;;/h1-3H3;1H3;/q2*-1;+3
InChIKeyQMMHMVKBQBUOEQ-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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Related Compounds

5,6-Dimethyl-2,4-dihydropyrimidine-2,4-diide;bis(yttrium)
CID 57531787
5-tert-butyl-2,6-dimethyl-4H-pyrimidin-4-ide;yttrium
CID 57696550
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
carbanide;4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium
CID 58651167
carbanide;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium
CID 58651181
2-chloro-5,6-dimethyl-4H-pyrimidin-4-ide;yttrium
CID 58956273
2-Methyl-4,5,6,7,8,9-hexahydrocyclohepta[d]pyrimidin-4-ide;yttrium
CID 59097993
2-Methyl-4,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-ide;yttrium
CID 59149842
2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium
CID 59560496
1,2,3,5,6-pentamethyl-4H-pyrimidine-1,3-diium-4-ide;rubidium(1+)
CID 59997626
4,5,6-trimethyl-2H-pyrimidin-2-ide;yttrium
CID 60010076

Frequently Asked Questions

What is the IUPAC name of carbanide;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium(3+)?
The IUPAC name of carbanide;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium(3+) (CID 21034538) is carbanide;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium(3+).
What is the SMILES notation for carbanide;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium(3+)?
The canonical SMILES for carbanide;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium(3+) is Cc1n[c-]c(C)c(C)n1.[CH3-].[Y+3].
What is the InChIKey of carbanide;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium(3+)?
The InChIKey is QMMHMVKBQBUOEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N2.CH3.Y/c1-5-4-8-7(3)9-6(5)2;;/h1-3H3;1H3;/q2*-1;+3.
What are the key properties of carbanide;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium(3+)?
carbanide;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium(3+) 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;2,5,6-trimethyl-4H-pyrimidin-4-ide;yttrium(3+) is sourced from PubChem (CID 21034538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).