2H-pyridin-2-ide-5-carbonyl chloride;yttrium

C6H3ClNOY- — CID 59799927

IUPAC2H-pyridin-2-ide-5-carbonyl chloride;yttrium
SMILESO=C(Cl)c1cc[c-]nc1.[Y]
InChIInChI=1S/C6H3ClNO.Y/c7-6(9)5-2-1-3-8-4-5;/h1-2,4H;/q-1;
InChIKeyPAUVFRIYCZZGLX-UHFFFAOYSA-N
MW229.46 g/mol
LogP1.26
Rot. Bonds1

About 2H-pyridin-2-ide-5-carbonyl chloride;yttrium

2H-pyridin-2-ide-5-carbonyl chloride;yttrium (PubChem CID 59799927) has the molecular formula C6H3ClNOY- and a molecular weight of 229.46 g/mol. Its IUPAC name is 2H-pyridin-2-ide-5-carbonyl chloride;yttrium.

Molecular Properties

Compound Name2H-pyridin-2-ide-5-carbonyl chloride;yttrium
PubChem CID59799927
Molecular FormulaC6H3ClNOY-
Molecular Weight229.46 g/mol
Exact Mass228.90
IUPAC Name2H-pyridin-2-ide-5-carbonyl chloride;yttrium
SMILESO=C(Cl)c1cc[c-]nc1.[Y]
InChIInChI=1S/C6H3ClNO.Y/c7-6(9)5-2-1-3-8-4-5;/h1-2,4H;/q-1;
InChIKeyPAUVFRIYCZZGLX-UHFFFAOYSA-N
XLogP1.26
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.46
LogP ≤ 51.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2H-pyridin-2-ide-5-carbonyl chloride;yttrium?
The IUPAC name of 2H-pyridin-2-ide-5-carbonyl chloride;yttrium (CID 59799927) is 2H-pyridin-2-ide-5-carbonyl chloride;yttrium.
What is the SMILES notation for 2H-pyridin-2-ide-5-carbonyl chloride;yttrium?
The canonical SMILES for 2H-pyridin-2-ide-5-carbonyl chloride;yttrium is O=C(Cl)c1cc[c-]nc1.[Y].
What is the InChIKey of 2H-pyridin-2-ide-5-carbonyl chloride;yttrium?
The InChIKey is PAUVFRIYCZZGLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3ClNO.Y/c7-6(9)5-2-1-3-8-4-5;/h1-2,4H;/q-1;.
What are the key properties of 2H-pyridin-2-ide-5-carbonyl chloride;yttrium?
2H-pyridin-2-ide-5-carbonyl chloride;yttrium has a molecular weight of 229.46 g/mol, XLogP of 1.26, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-pyridin-2-ide-5-carbonyl chloride;yttrium is sourced from PubChem (CID 59799927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).