2-phenylpyrrolidin-1-ide;yttrium

C10H11NY-2 — CID 134866257

IUPAC2-phenylpyrrolidin-1-ide;yttrium
SMILES[Y].[c-]1ccccc1C1CCC[N-]1
InChIInChI=1S/C10H11N.Y/c1-2-5-9(6-3-1)10-7-4-8-11-10;/h1-3,5,10H,4,7-8H2;/q-2;
InChIKeyKPKAENHLZHDSSO-UHFFFAOYSA-N
MW234.11 g/mol
LogP2.69
Rot. Bonds1

About 2-phenylpyrrolidin-1-ide;yttrium

2-phenylpyrrolidin-1-ide;yttrium (PubChem CID 134866257) has the molecular formula C10H11NY-2 and a molecular weight of 234.11 g/mol. Its IUPAC name is 2-phenylpyrrolidin-1-ide;yttrium.

Molecular Properties

Compound Name2-phenylpyrrolidin-1-ide;yttrium
PubChem CID134866257
Molecular FormulaC10H11NY-2
Molecular Weight234.11 g/mol
Exact Mass234.00
IUPAC Name2-phenylpyrrolidin-1-ide;yttrium
SMILES[Y].[c-]1ccccc1C1CCC[N-]1
InChIInChI=1S/C10H11N.Y/c1-2-5-9(6-3-1)10-7-4-8-11-10;/h1-3,5,10H,4,7-8H2;/q-2;
InChIKeyKPKAENHLZHDSSO-UHFFFAOYSA-N
XLogP2.69
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.11
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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-phenylpyrrolidin-1-ide;yttrium?
The IUPAC name of 2-phenylpyrrolidin-1-ide;yttrium (CID 134866257) is 2-phenylpyrrolidin-1-ide;yttrium.
What is the SMILES notation for 2-phenylpyrrolidin-1-ide;yttrium?
The canonical SMILES for 2-phenylpyrrolidin-1-ide;yttrium is [Y].[c-]1ccccc1C1CCC[N-]1.
What is the InChIKey of 2-phenylpyrrolidin-1-ide;yttrium?
The InChIKey is KPKAENHLZHDSSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N.Y/c1-2-5-9(6-3-1)10-7-4-8-11-10;/h1-3,5,10H,4,7-8H2;/q-2;.
What are the key properties of 2-phenylpyrrolidin-1-ide;yttrium?
2-phenylpyrrolidin-1-ide;yttrium has a molecular weight of 234.11 g/mol, XLogP of 2.69, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylpyrrolidin-1-ide;yttrium is sourced from PubChem (CID 134866257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).