1-ethyl-4,5-dimethyl-2H-imidazol-2-ide;yttrium

C7H10N2Y-2 — CID 59369889

IUPAC1-ethyl-4,5-dimethyl-2H-imidazol-2-ide;yttrium
SMILES[CH2-]Cn1[c-]nc(C)c1C.[Y]
InChIInChI=1S/C7H10N2.Y/c1-4-9-5-8-6(2)7(9)3;/h1,4H2,2-3H3;/q-2;
InChIKeyPKBGNRYMYBBBQP-UHFFFAOYSA-N
MW211.08 g/mol
LogP1.13
Rot. Bonds1

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

1-ethyl-4,5-dimethyl-2H-imidazol-2-ide;yttrium (PubChem CID 59369889) has the molecular formula C7H10N2Y-2 and a molecular weight of 211.08 g/mol. Its IUPAC name is 1-ethyl-4,5-dimethyl-2H-imidazol-2-ide;yttrium.

Molecular Properties

Compound Name1-ethyl-4,5-dimethyl-2H-imidazol-2-ide;yttrium
PubChem CID59369889
Molecular FormulaC7H10N2Y-2
Molecular Weight211.08 g/mol
Exact Mass210.99
IUPAC Name1-ethyl-4,5-dimethyl-2H-imidazol-2-ide;yttrium
SMILES[CH2-]Cn1[c-]nc(C)c1C.[Y]
InChIInChI=1S/C7H10N2.Y/c1-4-9-5-8-6(2)7(9)3;/h1,4H2,2-3H3;/q-2;
InChIKeyPKBGNRYMYBBBQP-UHFFFAOYSA-N
XLogP1.13
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.08
LogP ≤ 51.13
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

3-but-2-en-2-yl-5-methyl-4H-imidazol-4-ide;yttrium
CID 58883704

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4,5-dimethyl-2H-imidazol-2-ide;yttrium?
The IUPAC name of 1-ethyl-4,5-dimethyl-2H-imidazol-2-ide;yttrium (CID 59369889) is 1-ethyl-4,5-dimethyl-2H-imidazol-2-ide;yttrium.
What is the SMILES notation for 1-ethyl-4,5-dimethyl-2H-imidazol-2-ide;yttrium?
The canonical SMILES for 1-ethyl-4,5-dimethyl-2H-imidazol-2-ide;yttrium is [CH2-]Cn1[c-]nc(C)c1C.[Y].
What is the InChIKey of 1-ethyl-4,5-dimethyl-2H-imidazol-2-ide;yttrium?
The InChIKey is PKBGNRYMYBBBQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2.Y/c1-4-9-5-8-6(2)7(9)3;/h1,4H2,2-3H3;/q-2;.
What are the key properties of 1-ethyl-4,5-dimethyl-2H-imidazol-2-ide;yttrium?
1-ethyl-4,5-dimethyl-2H-imidazol-2-ide;yttrium has a molecular weight of 211.08 g/mol, XLogP of 1.13, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4,5-dimethyl-2H-imidazol-2-ide;yttrium is sourced from PubChem (CID 59369889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).