rubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide

C8H10NRb — CID 59014573

IUPACrubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide
SMILESCc1[c-]cnc(C)c1C.[Rb+]
InChIInChI=1S/C8H10N.Rb/c1-6-4-5-9-8(3)7(6)2;/h5H,1-3H3;/q-1;+1
InChIKeyFZNJCNKVSKJBOY-UHFFFAOYSA-N
MW205.64 g/mol
LogP-1.19
Rot. Bonds

About rubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide

rubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide (PubChem CID 59014573) has the molecular formula C8H10NRb and a molecular weight of 205.64 g/mol. Its IUPAC name is rubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide.

Molecular Properties

Compound Namerubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide
PubChem CID59014573
Molecular FormulaC8H10NRb
Molecular Weight205.64 g/mol
Exact Mass204.99
IUPAC Namerubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide
SMILESCc1[c-]cnc(C)c1C.[Rb+]
InChIInChI=1S/C8H10N.Rb/c1-6-4-5-9-8(3)7(6)2;/h5H,1-3H3;/q-1;+1
InChIKeyFZNJCNKVSKJBOY-UHFFFAOYSA-N
XLogP-1.19
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.64
LogP ≤ 5-1.19
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 rubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide?
The IUPAC name of rubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide (CID 59014573) is rubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide.
What is the SMILES notation for rubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide?
The canonical SMILES for rubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide is Cc1[c-]cnc(C)c1C.[Rb+].
What is the InChIKey of rubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide?
The InChIKey is FZNJCNKVSKJBOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N.Rb/c1-6-4-5-9-8(3)7(6)2;/h5H,1-3H3;/q-1;+1.
What are the key properties of rubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide?
rubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide has a molecular weight of 205.64 g/mol, XLogP of -1.19, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for rubidium(1+);4,5,6-trimethyl-3H-pyridin-3-ide is sourced from PubChem (CID 59014573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).