rhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide

C9H12NRbRe — CID 59997632

IUPACrhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide
SMILESCc1[c-]c(C)[n+](C)[c-]c1C.[Rb+].[Re]
InChIInChI=1S/C9H12N.Rb.Re/c1-7-5-9(3)10(4)6-8(7)2;;/h1-4H3;;/q-1;+1;
InChIKeyTZMFGOVWKQENKY-UHFFFAOYSA-N
MW405.88 g/mol
LogP-1.96
Rot. Bonds

About rhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide

rhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide (PubChem CID 59997632) has the molecular formula C9H12NRbRe and a molecular weight of 405.88 g/mol. Its IUPAC name is rhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide.

Molecular Properties

Compound Namerhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide
PubChem CID59997632
Molecular FormulaC9H12NRbRe
Molecular Weight405.88 g/mol
Exact Mass405.96
IUPAC Namerhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide
SMILESCc1[c-]c(C)[n+](C)[c-]c1C.[Rb+].[Re]
InChIInChI=1S/C9H12N.Rb.Re/c1-7-5-9(3)10(4)6-8(7)2;;/h1-4H3;;/q-1;+1;
InChIKeyTZMFGOVWKQENKY-UHFFFAOYSA-N
XLogP-1.96
TPSA3.88 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.88
LogP ≤ 5-1.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Related Compounds

3,4,5,6-tetramethyl-2H-pyridin-2-ide
CID 57713242
6-Ethenyl-1-ethyl-3,4-dimethyl-2,5-dihydropyridin-1-ium-2,5-diide;rhenium;rubidium(1+)
CID 59339957
6-Ethenyl-3,4-dimethyl-2,5-dihydropyridine-2,5-diide;rhenium;rubidium(1+)
CID 59339964
1,3,4,5,6-pentamethyl-2H-pyridin-1-ium-2-ide;yttrium
CID 60123687
1,3,4,5,6-pentamethyl-2H-pyridin-1-ium-2-ide
CID 21022302
1,3,4,6-tetramethyl-2H-pyridin-1-ium-2-ide
CID 59997633

Frequently Asked Questions

What is the IUPAC name of rhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide?
The IUPAC name of rhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide (CID 59997632) is rhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide.
What is the SMILES notation for rhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide?
The canonical SMILES for rhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide is Cc1[c-]c(C)[n+](C)[c-]c1C.[Rb+].[Re].
What is the InChIKey of rhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide?
The InChIKey is TZMFGOVWKQENKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N.Rb.Re/c1-7-5-9(3)10(4)6-8(7)2;;/h1-4H3;;/q-1;+1;.
What are the key properties of rhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide?
rhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide has a molecular weight of 405.88 g/mol, XLogP of -1.96, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for rhenium;rubidium(1+);1,3,4,6-tetramethyl-2,5-dihydropyridin-1-ium-2,5-diide is sourced from PubChem (CID 59997632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).