1,2,5-trimethyl-4H-imidazol-4-ide;yttrium

C6H9N2Y- — CID 58130771

IUPAC1,2,5-trimethyl-4H-imidazol-4-ide;yttrium
SMILESCc1[c-]nc(C)n1C.[Y]
InChIInChI=1S/C6H9N2.Y/c1-5-4-7-6(2)8(5)3;/h1-3H3;/q-1;
InChIKeyQJTOBBPTCXZMFY-UHFFFAOYSA-N
MW198.06 g/mol
LogP0.83
Rot. Bonds

About 1,2,5-trimethyl-4H-imidazol-4-ide;yttrium

1,2,5-trimethyl-4H-imidazol-4-ide;yttrium (PubChem CID 58130771) has the molecular formula C6H9N2Y- and a molecular weight of 198.06 g/mol. Its IUPAC name is 1,2,5-trimethyl-4H-imidazol-4-ide;yttrium.

Molecular Properties

Compound Name1,2,5-trimethyl-4H-imidazol-4-ide;yttrium
PubChem CID58130771
Molecular FormulaC6H9N2Y-
Molecular Weight198.06 g/mol
Exact Mass197.98
IUPAC Name1,2,5-trimethyl-4H-imidazol-4-ide;yttrium
SMILESCc1[c-]nc(C)n1C.[Y]
InChIInChI=1S/C6H9N2.Y/c1-5-4-7-6(2)8(5)3;/h1-3H3;/q-1;
InChIKeyQJTOBBPTCXZMFY-UHFFFAOYSA-N
XLogP0.83
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.06
LogP ≤ 50.83
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

1,1,2,4,5-Pentamethylimidazol-1-ium
CID 17775515
1,2,4,6-Tetramethylpyrimidine
CID 53690490
2,5-dimethyl-1-propan-2-yl-4H-imidazol-4-ide;yttrium
CID 58719482
rubidium(1+);2,3,5-trimethyl-4H-imidazol-4-ide
CID 59242000
ruthenium(1+);1,2,3,5-tetramethyl-4H-imidazol-3-ium-4-ide
CID 59997625
1,1,2,5-Tetramethylimidazol-1-ium
CID 67204801
1,1,2,4,5-Pentamethylimidazol-1-ium hydroxide
CID 118235036
N,N'-dimethyl-N-prop-1-en-2-ylethanimidamide
CID 125510032
2,3,5-trimethyl-4H-imidazol-4-ide;tungsten
CID 153560636
(2,5-dimethyl-4H-imidazol-4-id-1-yl)methanamine;yttrium
CID 160417086
1,2,3,5-tetramethyl-4H-imidazol-3-ium-4-ide
CID 20775680
1,1,2,4,5-Pentamethylimidazol-1-ium iodide
CID 21735267

Frequently Asked Questions

What is the IUPAC name of 1,2,5-trimethyl-4H-imidazol-4-ide;yttrium?
The IUPAC name of 1,2,5-trimethyl-4H-imidazol-4-ide;yttrium (CID 58130771) is 1,2,5-trimethyl-4H-imidazol-4-ide;yttrium.
What is the SMILES notation for 1,2,5-trimethyl-4H-imidazol-4-ide;yttrium?
The canonical SMILES for 1,2,5-trimethyl-4H-imidazol-4-ide;yttrium is Cc1[c-]nc(C)n1C.[Y].
What is the InChIKey of 1,2,5-trimethyl-4H-imidazol-4-ide;yttrium?
The InChIKey is QJTOBBPTCXZMFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N2.Y/c1-5-4-7-6(2)8(5)3;/h1-3H3;/q-1;.
What are the key properties of 1,2,5-trimethyl-4H-imidazol-4-ide;yttrium?
1,2,5-trimethyl-4H-imidazol-4-ide;yttrium has a molecular weight of 198.06 g/mol, XLogP of 0.83, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,5-trimethyl-4H-imidazol-4-ide;yttrium is sourced from PubChem (CID 58130771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).