2H-pyridin-2-ide-5-carboxylic acid;yttrium

C6H4NO2Y- — CID 59093786

IUPAC2H-pyridin-2-ide-5-carboxylic acid;yttrium
SMILESO=C(O)c1cc[c-]nc1.[Y]
InChIInChI=1S/C6H4NO2.Y/c8-6(9)5-2-1-3-7-4-5;/h1-2,4H,(H,8,9);/q-1;
InChIKeyZSAZZNVZIGPFFX-UHFFFAOYSA-N
MW211.01 g/mol
LogP0.58
Rot. Bonds1

About 2H-pyridin-2-ide-5-carboxylic acid;yttrium

2H-pyridin-2-ide-5-carboxylic acid;yttrium (PubChem CID 59093786) has the molecular formula C6H4NO2Y- and a molecular weight of 211.01 g/mol. Its IUPAC name is 2H-pyridin-2-ide-5-carboxylic acid;yttrium.

Molecular Properties

Compound Name2H-pyridin-2-ide-5-carboxylic acid;yttrium
PubChem CID59093786
Molecular FormulaC6H4NO2Y-
Molecular Weight211.01 g/mol
Exact Mass210.93
IUPAC Name2H-pyridin-2-ide-5-carboxylic acid;yttrium
SMILESO=C(O)c1cc[c-]nc1.[Y]
InChIInChI=1S/C6H4NO2.Y/c8-6(9)5-2-1-3-7-4-5;/h1-2,4H,(H,8,9);/q-1;
InChIKeyZSAZZNVZIGPFFX-UHFFFAOYSA-N
XLogP0.58
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.01
LogP ≤ 50.58
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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Related Compounds

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2-methyl-3H-pyridin-3-ide-5-carboxylic acid;yttrium
CID 57779827
2H-pyridin-2-ide-5-carboxylic acid;tungsten
CID 58720230
2H-pyridin-2-ide-5-carboxylic acid;vanadium
CID 58764342
2H-pyridin-2-ide-4-carboxylic acid;tungsten
CID 59061962
2H-pyridin-2-ide-4-carboxylic acid;yttrium
CID 59077464
carbanide;2H-pyridin-2-ide-3-carboxylic acid;vanadium;yttrium
CID 59265021
Azocine-3-carboxylic acid
CID 70084235
lithium 2H-pyridin-2-ide-3-carboxylic acid
CID 87944914
(Z)-2-methylidene-5-methyliminopent-3-enoic acid
CID 88264885
(Z,2E)-2-[(methylideneamino)methylidene]pent-3-enoic acid
CID 130440427

Frequently Asked Questions

What is the IUPAC name of 2H-pyridin-2-ide-5-carboxylic acid;yttrium?
The IUPAC name of 2H-pyridin-2-ide-5-carboxylic acid;yttrium (CID 59093786) is 2H-pyridin-2-ide-5-carboxylic acid;yttrium.
What is the SMILES notation for 2H-pyridin-2-ide-5-carboxylic acid;yttrium?
The canonical SMILES for 2H-pyridin-2-ide-5-carboxylic acid;yttrium is O=C(O)c1cc[c-]nc1.[Y].
What is the InChIKey of 2H-pyridin-2-ide-5-carboxylic acid;yttrium?
The InChIKey is ZSAZZNVZIGPFFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4NO2.Y/c8-6(9)5-2-1-3-7-4-5;/h1-2,4H,(H,8,9);/q-1;.
What are the key properties of 2H-pyridin-2-ide-5-carboxylic acid;yttrium?
2H-pyridin-2-ide-5-carboxylic acid;yttrium has a molecular weight of 211.01 g/mol, XLogP of 0.58, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-pyridin-2-ide-5-carboxylic acid;yttrium is sourced from PubChem (CID 59093786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).