potassium 2-methyl-6-tritio-3H-pyridin-3-ide

C6H6KN — CID 59128607

IUPACpotassium 2-methyl-6-tritio-3H-pyridin-3-ide
SMILES[3H]c1cc[c-]c(C)n1.[K+]
InChIInChI=1S/C6H6N.K/c1-6-4-2-3-5-7-6;/h2-3,5H,1H3;/q-1;+1/i5T;
InChIKeyLGZGOIKNSVKRBX-NRXBRZBTSA-N
MW133.23 g/mol
LogP-1.81
Rot. Bonds

About potassium 2-methyl-6-tritio-3H-pyridin-3-ide

potassium 2-methyl-6-tritio-3H-pyridin-3-ide (PubChem CID 59128607) has the molecular formula C6H6KN and a molecular weight of 133.23 g/mol. Its IUPAC name is potassium 2-methyl-6-tritio-3H-pyridin-3-ide.

Molecular Properties

Compound Namepotassium 2-methyl-6-tritio-3H-pyridin-3-ide
PubChem CID59128607
Molecular FormulaC6H6KN
Molecular Weight133.23 g/mol
Exact Mass133.02
IUPAC Namepotassium 2-methyl-6-tritio-3H-pyridin-3-ide
SMILES[3H]c1cc[c-]c(C)n1.[K+]
InChIInChI=1S/C6H6N.K/c1-6-4-2-3-5-7-6;/h2-3,5H,1H3;/q-1;+1/i5T;
InChIKeyLGZGOIKNSVKRBX-NRXBRZBTSA-N
XLogP-1.81
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.23
LogP ≤ 5-1.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of potassium 2-methyl-6-tritio-3H-pyridin-3-ide?
The IUPAC name of potassium 2-methyl-6-tritio-3H-pyridin-3-ide (CID 59128607) is potassium 2-methyl-6-tritio-3H-pyridin-3-ide.
What is the SMILES notation for potassium 2-methyl-6-tritio-3H-pyridin-3-ide?
The canonical SMILES for potassium 2-methyl-6-tritio-3H-pyridin-3-ide is [3H]c1cc[c-]c(C)n1.[K+].
What is the InChIKey of potassium 2-methyl-6-tritio-3H-pyridin-3-ide?
The InChIKey is LGZGOIKNSVKRBX-NRXBRZBTSA-N. The full InChI is InChI=1S/C6H6N.K/c1-6-4-2-3-5-7-6;/h2-3,5H,1H3;/q-1;+1/i5T;.
What are the key properties of potassium 2-methyl-6-tritio-3H-pyridin-3-ide?
potassium 2-methyl-6-tritio-3H-pyridin-3-ide has a molecular weight of 133.23 g/mol, XLogP of -1.81, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 2-methyl-6-tritio-3H-pyridin-3-ide is sourced from PubChem (CID 59128607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).