2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium

C8H10N2Y-2 — CID 58883613

IUPAC2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium
SMILESC/[C-]=C/n1[c-]c(C)nc1C.[Y]
InChIInChI=1S/C8H10N2.Y/c1-4-5-10-6-7(2)9-8(10)3;/h5H,1-3H3;/q-2;
InChIKeyUKJZCKHVRGCHTF-UHFFFAOYSA-N
MW223.09 g/mol
LogP1.59
Rot. Bonds1

About 2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium

2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium (PubChem CID 58883613) has the molecular formula C8H10N2Y-2 and a molecular weight of 223.09 g/mol. Its IUPAC name is 2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium.

Molecular Properties

Compound Name2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium
PubChem CID58883613
Molecular FormulaC8H10N2Y-2
Molecular Weight223.09 g/mol
Exact Mass222.99
IUPAC Name2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium
SMILESC/[C-]=C/n1[c-]c(C)nc1C.[Y]
InChIInChI=1S/C8H10N2.Y/c1-4-5-10-6-7(2)9-8(10)3;/h5H,1-3H3;/q-2;
InChIKeyUKJZCKHVRGCHTF-UHFFFAOYSA-N
XLogP1.59
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.09
LogP ≤ 51.59
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-2-methyl-4H-imidazol-4-ide;yttrium
CID 58883619
1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;yttrium
CID 58883621
4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;yttrium
CID 58883670
1,1,2,4-Tetramethylimidazol-1-ium
CID 67205164
N,N-dimethyl-N'-[(Z)-2-(methylideneamino)prop-1-enyl]ethanimidamide
CID 143787004

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium?
The IUPAC name of 2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium (CID 58883613) is 2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium.
What is the SMILES notation for 2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium?
The canonical SMILES for 2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium is C/[C-]=C/n1[c-]c(C)nc1C.[Y].
What is the InChIKey of 2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium?
The InChIKey is UKJZCKHVRGCHTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2.Y/c1-4-5-10-6-7(2)9-8(10)3;/h5H,1-3H3;/q-2;.
What are the key properties of 2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium?
2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium has a molecular weight of 223.09 g/mol, XLogP of 1.59, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-3-prop-1-enyl-4H-imidazol-4-ide;yttrium is sourced from PubChem (CID 58883613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).