3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium

C14H8N2OY-2 — CID 58813576

IUPAC3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium
SMILES[Y].[c-]1nc(-c2ccccn2)ccc1-c1[c-]cco1
InChIInChI=1S/C14H8N2O.Y/c1-2-8-15-12(4-1)13-7-6-11(10-16-13)14-5-3-9-17-14;/h1-4,6-9H;/q-2;
InChIKeyAHSYPNZFUZFSLP-UHFFFAOYSA-N
MW309.14 g/mol
LogP3.00
Rot. Bonds2

About 3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium

3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium (PubChem CID 58813576) has the molecular formula C14H8N2OY-2 and a molecular weight of 309.14 g/mol. Its IUPAC name is 3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium.

Molecular Properties

Compound Name3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium
PubChem CID58813576
Molecular FormulaC14H8N2OY-2
Molecular Weight309.14 g/mol
Exact Mass308.97
IUPAC Name3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium
SMILES[Y].[c-]1nc(-c2ccccn2)ccc1-c1[c-]cco1
InChIInChI=1S/C14H8N2O.Y/c1-2-8-15-12(4-1)13-7-6-11(10-16-13)14-5-3-9-17-14;/h1-4,6-9H;/q-2;
InChIKeyAHSYPNZFUZFSLP-UHFFFAOYSA-N
XLogP3.00
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.14
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(2H-furan-2-id-3-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium
CID 58813789
3-(2H-naphthalen-2-id-1-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium
CID 58813552
pyrrolo[3,2-b]azepine
CID 66934182
tris(2-pyridin-2-ylpyridine);ruthenium
CID 6100643
2-pyridin-2-ylpyridine;hydroiodide
CID 172833113
2-pyridin-2-ylpyridine;ruthenium(2+)
CID 140596360
bis(2-pyridin-2-ylpyridine);ruthenium
CID 87118114
nickel;tris(2-pyridin-2-ylpyridine)
CID 76737267
2-pyridin-2-ylpyridine;rhenium;tetrachloride
CID 52939847
2-pyridin-2-ylpyridine;dihydroiodide
CID 173445353
disodium;hydride;2-pyridin-2-ylpyridine
CID 174959125
iridium;2-pyridin-2-ylpyridine;ruthenium
CID 174707743

Frequently Asked Questions

What is the IUPAC name of 3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium?
The IUPAC name of 3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium (CID 58813576) is 3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium.
What is the SMILES notation for 3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium?
The canonical SMILES for 3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium is [Y].[c-]1nc(-c2ccccn2)ccc1-c1[c-]cco1.
What is the InChIKey of 3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium?
The InChIKey is AHSYPNZFUZFSLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8N2O.Y/c1-2-8-15-12(4-1)13-7-6-11(10-16-13)14-5-3-9-17-14;/h1-4,6-9H;/q-2;.
What are the key properties of 3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium?
3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium has a molecular weight of 309.14 g/mol, XLogP of 3.00, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3H-furan-3-id-2-yl)-6-pyridin-2-yl-2H-pyridin-2-ide;yttrium is sourced from PubChem (CID 58813576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).