3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+)

C9H14N2Rb+ — CID 59339962

IUPAC3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+)
SMILESC=C[n+]1[c-]c(C)n(CC)c1C.[Rb+]
InChIInChI=1S/C9H14N2.Rb/c1-5-10-7-8(3)11(6-2)9(10)4;/h5H,1,6H2,2-4H3;/q;+1
InChIKeyAMDBQHYWXZJJDS-UHFFFAOYSA-N
MW235.69 g/mol
LogP-1.68
Rot. Bonds2

About 3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+)

3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+) (PubChem CID 59339962) has the molecular formula C9H14N2Rb+ and a molecular weight of 235.69 g/mol. Its IUPAC name is 3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+).

Molecular Properties

Compound Name3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+)
PubChem CID59339962
Molecular FormulaC9H14N2Rb+
Molecular Weight235.69 g/mol
Exact Mass235.03
IUPAC Name3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+)
SMILESC=C[n+]1[c-]c(C)n(CC)c1C.[Rb+]
InChIInChI=1S/C9H14N2.Rb/c1-5-10-7-8(3)11(6-2)9(10)4;/h5H,1,6H2,2-4H3;/q;+1
InChIKeyAMDBQHYWXZJJDS-UHFFFAOYSA-N
XLogP-1.68
TPSA8.81 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.69
LogP ≤ 5-1.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Related Compounds

3-ethenyl-2,5-dimethyl-4H-imidazol-4-ide;rubidium(1+)
CID 59339956
1,1,2,5-Tetramethylimidazol-1-ium
CID 67204801
1,1,2,4-Tetramethylimidazol-1-ium
CID 67205164
1-Ethyl-1,2-dimethylimidazol-1-ium
CID 67388276
1-Butyl-1,2,4-trimethylimidazol-1-ium
CID 122699323
2,3-dimethyl-5-methylidene-N-[(Z)-prop-1-enyl]imidazol-4-imine
CID 129259209
N-ethenyl-1,6-dimethylpyrazin-2-imine
CID 139437425
N,N'-bis(ethenyl)-N-ethylethanimidamide
CID 142369071
1,2-Dimethyl-1-propylimidazol-1-ium
CID 150356977
1,1-Diethyl-2-methylimidazol-1-ium
CID 150422346
N-ethenyl-N'-methyl-N-propan-2-ylethanimidamide
CID 154656281
N'-butan-2-yl-N-ethenyl-N-propan-2-ylethanimidamide
CID 154967755

Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+)?
The IUPAC name of 3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+) (CID 59339962) is 3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+).
What is the SMILES notation for 3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+)?
The canonical SMILES for 3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+) is C=C[n+]1[c-]c(C)n(CC)c1C.[Rb+].
What is the InChIKey of 3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+)?
The InChIKey is AMDBQHYWXZJJDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2.Rb/c1-5-10-7-8(3)11(6-2)9(10)4;/h5H,1,6H2,2-4H3;/q;+1.
What are the key properties of 3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+)?
3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+) has a molecular weight of 235.69 g/mol, XLogP of -1.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-1-ethyl-2,5-dimethyl-4H-imidazol-3-ium-4-ide;rubidium(1+) is sourced from PubChem (CID 59339962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).