4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+)

C7H8NRb — CID 88589675

IUPAC4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+)
SMILESCc1[c-]cnc(C)c1.[Rb+]
InChIInChI=1S/C7H8N.Rb/c1-6-3-4-8-7(2)5-6;/h4-5H,1-2H3;/q-1;+1
InChIKeyCWRNKLFUPVFIIA-UHFFFAOYSA-N
MW191.62 g/mol
LogP-1.50
Rot. Bonds

About 4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+)

4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+) (PubChem CID 88589675) has the molecular formula C7H8NRb and a molecular weight of 191.62 g/mol. Its IUPAC name is 4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+).

Molecular Properties

Compound Name4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+)
PubChem CID88589675
Molecular FormulaC7H8NRb
Molecular Weight191.62 g/mol
Exact Mass190.98
IUPAC Name4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+)
SMILESCc1[c-]cnc(C)c1.[Rb+]
InChIInChI=1S/C7H8N.Rb/c1-6-3-4-8-7(2)5-6;/h4-5H,1-2H3;/q-1;+1
InChIKeyCWRNKLFUPVFIIA-UHFFFAOYSA-N
XLogP-1.50
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.62
LogP ≤ 5-1.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+)?
The IUPAC name of 4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+) (CID 88589675) is 4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+).
What is the SMILES notation for 4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+)?
The canonical SMILES for 4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+) is Cc1[c-]cnc(C)c1.[Rb+].
What is the InChIKey of 4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+)?
The InChIKey is CWRNKLFUPVFIIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N.Rb/c1-6-3-4-8-7(2)5-6;/h4-5H,1-2H3;/q-1;+1.
What are the key properties of 4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+)?
4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+) has a molecular weight of 191.62 g/mol, XLogP of -1.50, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-3H-pyridin-3-ide;rubidium(1+) is sourced from PubChem (CID 88589675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).