3-phenyl-2H-pyridin-2-ide;yttrium

C11H7NY-2 — CID 58813895

IUPAC3-phenyl-2H-pyridin-2-ide;yttrium
SMILES[Y].[c-]1ccccc1-c1[c-]nccc1
InChIInChI=1S/C11H7N.Y/c1-2-5-10(6-3-1)11-7-4-8-12-9-11;/h1-5,7-8H;/q-2;
InChIKeyNTOJOPDDCBLMJS-UHFFFAOYSA-N
MW242.09 g/mol
LogP2.35
Rot. Bonds1

About 3-phenyl-2H-pyridin-2-ide;yttrium

3-phenyl-2H-pyridin-2-ide;yttrium (PubChem CID 58813895) has the molecular formula C11H7NY-2 and a molecular weight of 242.09 g/mol. Its IUPAC name is 3-phenyl-2H-pyridin-2-ide;yttrium.

Molecular Properties

Compound Name3-phenyl-2H-pyridin-2-ide;yttrium
PubChem CID58813895
Molecular FormulaC11H7NY-2
Molecular Weight242.09 g/mol
Exact Mass241.96
IUPAC Name3-phenyl-2H-pyridin-2-ide;yttrium
SMILES[Y].[c-]1ccccc1-c1[c-]nccc1
InChIInChI=1S/C11H7N.Y/c1-2-5-10(6-3-1)11-7-4-8-12-9-11;/h1-5,7-8H;/q-2;
InChIKeyNTOJOPDDCBLMJS-UHFFFAOYSA-N
XLogP2.35
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.09
LogP ≤ 52.35
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 3-phenyl-2H-pyridin-2-ide;yttrium?
The IUPAC name of 3-phenyl-2H-pyridin-2-ide;yttrium (CID 58813895) is 3-phenyl-2H-pyridin-2-ide;yttrium.
What is the SMILES notation for 3-phenyl-2H-pyridin-2-ide;yttrium?
The canonical SMILES for 3-phenyl-2H-pyridin-2-ide;yttrium is [Y].[c-]1ccccc1-c1[c-]nccc1.
What is the InChIKey of 3-phenyl-2H-pyridin-2-ide;yttrium?
The InChIKey is NTOJOPDDCBLMJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N.Y/c1-2-5-10(6-3-1)11-7-4-8-12-9-11;/h1-5,7-8H;/q-2;.
What are the key properties of 3-phenyl-2H-pyridin-2-ide;yttrium?
3-phenyl-2H-pyridin-2-ide;yttrium has a molecular weight of 242.09 g/mol, XLogP of 2.35, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-2H-pyridin-2-ide;yttrium is sourced from PubChem (CID 58813895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).