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

C6H6NY- — CID 59098033

IUPAC2-methyl-3H-pyridin-3-ide;yttrium
SMILESCc1[c-]cccn1.[Y]
InChIInChI=1S/C6H6N.Y/c1-6-4-2-3-5-7-6;/h2-3,5H,1H3;/q-1;
InChIKeyNZIMBQTZJXJGPS-UHFFFAOYSA-N
MW181.03 g/mol
LogP1.19
Rot. Bonds

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

2-methyl-3H-pyridin-3-ide;yttrium (PubChem CID 59098033) has the molecular formula C6H6NY- and a molecular weight of 181.03 g/mol. Its IUPAC name is 2-methyl-3H-pyridin-3-ide;yttrium.

Molecular Properties

Compound Name2-methyl-3H-pyridin-3-ide;yttrium
PubChem CID59098033
Molecular FormulaC6H6NY-
Molecular Weight181.03 g/mol
Exact Mass180.96
IUPAC Name2-methyl-3H-pyridin-3-ide;yttrium
SMILESCc1[c-]cccn1.[Y]
InChIInChI=1S/C6H6N.Y/c1-6-4-2-3-5-7-6;/h2-3,5H,1H3;/q-1;
InChIKeyNZIMBQTZJXJGPS-UHFFFAOYSA-N
XLogP1.19
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.03
LogP ≤ 51.19
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-methyl-3H-pyridin-3-ide;yttrium?
The IUPAC name of 2-methyl-3H-pyridin-3-ide;yttrium (CID 59098033) is 2-methyl-3H-pyridin-3-ide;yttrium.
What is the SMILES notation for 2-methyl-3H-pyridin-3-ide;yttrium?
The canonical SMILES for 2-methyl-3H-pyridin-3-ide;yttrium is Cc1[c-]cccn1.[Y].
What is the InChIKey of 2-methyl-3H-pyridin-3-ide;yttrium?
The InChIKey is NZIMBQTZJXJGPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N.Y/c1-6-4-2-3-5-7-6;/h2-3,5H,1H3;/q-1;.
What are the key properties of 2-methyl-3H-pyridin-3-ide;yttrium?
2-methyl-3H-pyridin-3-ide;yttrium has a molecular weight of 181.03 g/mol, XLogP of 1.19, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3H-pyridin-3-ide;yttrium is sourced from PubChem (CID 59098033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).