potassium 1H-imidazole

C3H4KN2+ — CID 18415043

IUPACpotassium 1H-imidazole
SMILES[K+].c1c[nH]cn1
InChIInChI=1S/C3H4N2.K/c1-2-5-3-4-1;/h1-3H,(H,4,5);/q;+1
InChIKeyRVTSQOJSRPVCML-UHFFFAOYSA-N
MW107.18 g/mol
LogP-2.59
Rot. Bonds

About potassium 1H-imidazole

potassium 1H-imidazole (PubChem CID 18415043) has the molecular formula C3H4KN2+ and a molecular weight of 107.18 g/mol. Its IUPAC name is potassium 1H-imidazole.

Molecular Properties

Compound Namepotassium 1H-imidazole
PubChem CID18415043
Molecular FormulaC3H4KN2+
Molecular Weight107.18 g/mol
Exact Mass107.00
IUPAC Namepotassium 1H-imidazole
SMILES[K+].c1c[nH]cn1
InChIInChI=1S/C3H4N2.K/c1-2-5-3-4-1;/h1-3H,(H,4,5);/q;+1
InChIKeyRVTSQOJSRPVCML-UHFFFAOYSA-N
XLogP-2.59
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.18
LogP ≤ 5-2.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of potassium 1H-imidazole?
The IUPAC name of potassium 1H-imidazole (CID 18415043) is potassium 1H-imidazole.
What is the SMILES notation for potassium 1H-imidazole?
The canonical SMILES for potassium 1H-imidazole is [K+].c1c[nH]cn1.
What is the InChIKey of potassium 1H-imidazole?
The InChIKey is RVTSQOJSRPVCML-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4N2.K/c1-2-5-3-4-1;/h1-3H,(H,4,5);/q;+1.
What are the key properties of potassium 1H-imidazole?
potassium 1H-imidazole has a molecular weight of 107.18 g/mol, XLogP of -2.59, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 1H-imidazole is sourced from PubChem (CID 18415043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).