2,5-dimethyl-3H-pyridin-3-ide;yttrium

C7H8NY- — CID 59383484

IUPAC2,5-dimethyl-3H-pyridin-3-ide;yttrium
SMILESCc1c[c-]c(C)nc1.[Y]
InChIInChI=1S/C7H8N.Y/c1-6-3-4-7(2)8-5-6;/h3,5H,1-2H3;/q-1;
InChIKeyLPGYLTNRSBBKFA-UHFFFAOYSA-N
MW195.05 g/mol
LogP1.50
Rot. Bonds

About 2,5-dimethyl-3H-pyridin-3-ide;yttrium

2,5-dimethyl-3H-pyridin-3-ide;yttrium (PubChem CID 59383484) has the molecular formula C7H8NY- and a molecular weight of 195.05 g/mol. Its IUPAC name is 2,5-dimethyl-3H-pyridin-3-ide;yttrium.

Molecular Properties

Compound Name2,5-dimethyl-3H-pyridin-3-ide;yttrium
PubChem CID59383484
Molecular FormulaC7H8NY-
Molecular Weight195.05 g/mol
Exact Mass194.97
IUPAC Name2,5-dimethyl-3H-pyridin-3-ide;yttrium
SMILESCc1c[c-]c(C)nc1.[Y]
InChIInChI=1S/C7H8N.Y/c1-6-3-4-7(2)8-5-6;/h3,5H,1-2H3;/q-1;
InChIKeyLPGYLTNRSBBKFA-UHFFFAOYSA-N
XLogP1.50
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.05
LogP ≤ 51.50
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 2,5-dimethyl-3H-pyridin-3-ide;yttrium?
The IUPAC name of 2,5-dimethyl-3H-pyridin-3-ide;yttrium (CID 59383484) is 2,5-dimethyl-3H-pyridin-3-ide;yttrium.
What is the SMILES notation for 2,5-dimethyl-3H-pyridin-3-ide;yttrium?
The canonical SMILES for 2,5-dimethyl-3H-pyridin-3-ide;yttrium is Cc1c[c-]c(C)nc1.[Y].
What is the InChIKey of 2,5-dimethyl-3H-pyridin-3-ide;yttrium?
The InChIKey is LPGYLTNRSBBKFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N.Y/c1-6-3-4-7(2)8-5-6;/h3,5H,1-2H3;/q-1;.
What are the key properties of 2,5-dimethyl-3H-pyridin-3-ide;yttrium?
2,5-dimethyl-3H-pyridin-3-ide;yttrium has a molecular weight of 195.05 g/mol, XLogP of 1.50, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-3H-pyridin-3-ide;yttrium is sourced from PubChem (CID 59383484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).