1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+)

C6H4N3W+ — CID 54680668

IUPAC1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+)
SMILES[W+2].[c-]1ccc2[nH]cnc2n1
InChIInChI=1S/C6H4N3.W/c1-2-5-6(7-3-1)9-4-8-5;/h1-2,4H,(H,7,8,9);/q-1;+2
InChIKeyYWPQYTAPOBWGKY-UHFFFAOYSA-N
MW301.96 g/mol
LogP0.76
Rot. Bonds

About 1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+)

1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+) (PubChem CID 54680668) has the molecular formula C6H4N3W+ and a molecular weight of 301.96 g/mol. Its IUPAC name is 1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+).

Molecular Properties

Compound Name1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+)
PubChem CID54680668
Molecular FormulaC6H4N3W+
Molecular Weight301.96 g/mol
Exact Mass301.99
IUPAC Name1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+)
SMILES[W+2].[c-]1ccc2[nH]cnc2n1
InChIInChI=1S/C6H4N3.W/c1-2-5-6(7-3-1)9-4-8-5;/h1-2,4H,(H,7,8,9);/q-1;+2
InChIKeyYWPQYTAPOBWGKY-UHFFFAOYSA-N
XLogP0.76
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.96
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+)?
The IUPAC name of 1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+) (CID 54680668) is 1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+).
What is the SMILES notation for 1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+)?
The canonical SMILES for 1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+) is [W+2].[c-]1ccc2[nH]cnc2n1.
What is the InChIKey of 1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+)?
The InChIKey is YWPQYTAPOBWGKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N3.W/c1-2-5-6(7-3-1)9-4-8-5;/h1-2,4H,(H,7,8,9);/q-1;+2.
What are the key properties of 1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+)?
1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+) has a molecular weight of 301.96 g/mol, XLogP of 0.76, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dihydroimidazo[4,5-b]pyridin-5-ide;tungsten(2+) is sourced from PubChem (CID 54680668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).