3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium

C6H8NO2Y- — CID 59957086

IUPAC3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium
SMILESCC1C(=O)[N-]C(=O)C1C.[Y]
InChIInChI=1S/C6H9NO2.Y/c1-3-4(2)6(9)7-5(3)8;/h3-4H,1-2H3,(H,7,8,9);/p-1
InChIKeyQXPQXUSMPDUNCI-UHFFFAOYSA-M
MW215.04 g/mol
LogP0.70
Rot. Bonds

About 3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium

3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium (PubChem CID 59957086) has the molecular formula C6H8NO2Y- and a molecular weight of 215.04 g/mol. Its IUPAC name is 3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium.

Molecular Properties

Compound Name3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium
PubChem CID59957086
Molecular FormulaC6H8NO2Y-
Molecular Weight215.04 g/mol
Exact Mass214.96
IUPAC Name3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium
SMILESCC1C(=O)[N-]C(=O)C1C.[Y]
InChIInChI=1S/C6H9NO2.Y/c1-3-4(2)6(9)7-5(3)8;/h3-4H,1-2H3,(H,7,8,9);/p-1
InChIKeyQXPQXUSMPDUNCI-UHFFFAOYSA-M
XLogP0.70
TPSA48.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.04
LogP ≤ 50.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

3,4-Dimethylpyrrolidine-2,5-dione
CID 3550866
1,3-Dimethylpyrrolidine-2,5-dione
CID 85866
(3R,4R)-3,4-dimethylpyrrolidine-2,5-dione
CID 337234
(3R,4S)-1,3,4-trimethylpyrrolidine-2,5-dione
CID 58738334
3,4-Dimethyl-1-(trifluoromethyl)pyrrolidine-2,5-dione
CID 18336295
(3,4-Dimethyl-2,5-dioxopyrrolidin-1-yl) hypofluorite
CID 142457368
(3R,4S)-3,4-dimethylpyrrolidine-2,5-dione
CID 642605
1,3,4-Trimethylpyrrolidine-2,5-dione
CID 12394585
(3S,4S)-1,3,4-trimethylpyrrolidine-2,5-dione
CID 5325754
(R)-1,3-Dimethylpyrrolidine-2,5-dione
CID 1394791
(3S)-1,3-Dimethyl-2,5-pyrrolidinedione
CID 12991007
1-Bromo-3-methylpyrrolidine-2,5-dione
CID 13410045

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium?
The IUPAC name of 3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium (CID 59957086) is 3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium.
What is the SMILES notation for 3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium?
The canonical SMILES for 3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium is CC1C(=O)[N-]C(=O)C1C.[Y].
What is the InChIKey of 3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium?
The InChIKey is QXPQXUSMPDUNCI-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H9NO2.Y/c1-3-4(2)6(9)7-5(3)8;/h3-4H,1-2H3,(H,7,8,9);/p-1.
What are the key properties of 3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium?
3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium has a molecular weight of 215.04 g/mol, XLogP of 0.70, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethylpyrrolidin-1-ide-2,5-dione;yttrium is sourced from PubChem (CID 59957086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).