potassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide

C5H7KN2 — CID 177171986

IUPACpotassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide
SMILESCc1[c-]nc(C)[nH]1.[K+]
InChIInChI=1S/C5H7N2.K/c1-4-3-6-5(2)7-4;/h1-2H3,(H,6,7);/q-1;+1
InChIKeyJAQFQXHZLCIJAN-UHFFFAOYSA-N
MW134.22 g/mol
LogP-2.17
Rot. Bonds

About potassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide

potassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide (PubChem CID 177171986) has the molecular formula C5H7KN2 and a molecular weight of 134.22 g/mol. Its IUPAC name is potassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide.

Molecular Properties

Compound Namepotassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide
PubChem CID177171986
Molecular FormulaC5H7KN2
Molecular Weight134.22 g/mol
Exact Mass134.02
IUPAC Namepotassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide
SMILESCc1[c-]nc(C)[nH]1.[K+]
InChIInChI=1S/C5H7N2.K/c1-4-3-6-5(2)7-4;/h1-2H3,(H,6,7);/q-1;+1
InChIKeyJAQFQXHZLCIJAN-UHFFFAOYSA-N
XLogP-2.17
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.22
LogP ≤ 5-2.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2,4,5-trimethyl-1H-imidazol-1-ium chloride
CID 19877192
2,5-Dimethyl-1,4-dihydroimidazol-4-ide;yttrium
CID 58637027
2,5-Dimethyl-1,4-dihydroimidazol-4-ide;ethane;rubidium(1+)
CID 145589300
2,5-Dimethyl-1,4-dihydroimidazol-4-ide;rhodium
CID 156809624

Frequently Asked Questions

What is the IUPAC name of potassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide?
The IUPAC name of potassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide (CID 177171986) is potassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide.
What is the SMILES notation for potassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide?
The canonical SMILES for potassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide is Cc1[c-]nc(C)[nH]1.[K+].
What is the InChIKey of potassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide?
The InChIKey is JAQFQXHZLCIJAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N2.K/c1-4-3-6-5(2)7-4;/h1-2H3,(H,6,7);/q-1;+1.
What are the key properties of potassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide?
potassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide has a molecular weight of 134.22 g/mol, XLogP of -2.17, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 2,5-dimethyl-1,4-dihydroimidazol-4-ide is sourced from PubChem (CID 177171986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).