1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium

C7H10NO2S2Y- — CID 58713838

IUPAC1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium
SMILESC[C-](S)SC1CC(=O)N(C)C1=O.[Y]
InChIInChI=1S/C7H10NO2S2.Y/c1-4(11)12-5-3-6(9)8(2)7(5)10;/h5,11H,3H2,1-2H3;/q-1;
InChIKeySRFXOLIHYAMXGE-UHFFFAOYSA-N
MW293.20 g/mol
LogP0.91
Rot. Bonds2

About 1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium

1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium (PubChem CID 58713838) has the molecular formula C7H10NO2S2Y- and a molecular weight of 293.20 g/mol. Its IUPAC name is 1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium.

Molecular Properties

Compound Name1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium
PubChem CID58713838
Molecular FormulaC7H10NO2S2Y-
Molecular Weight293.20 g/mol
Exact Mass292.92
IUPAC Name1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium
SMILESC[C-](S)SC1CC(=O)N(C)C1=O.[Y]
InChIInChI=1S/C7H10NO2S2.Y/c1-4(11)12-5-3-6(9)8(2)7(5)10;/h5,11H,3H2,1-2H3;/q-1;
InChIKeySRFXOLIHYAMXGE-UHFFFAOYSA-N
XLogP0.91
TPSA37.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.20
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

3-alumanylsulfanyl-1-methylpyrrolidine-2,5-dione
CID 163606651
ethane;1-methyl-3-(methyldisulfanyl)pyrrolidine-2,5-dione
CID 176950350
methanethiol;1-methyl-3-methylsulfanylpyrrolidine-2,5-dione;1-methylpyrrole-2,5-dione
CID 160581032
3-(2-aminophenyl)sulfanyl-1-methylpyrrolidine-2,5-dione
CID 14956141
2-methyl-3-(1-methyl-2,5-dioxopyrrolidin-3-yl)sulfanylpropanoic acid
CID 64916699
(1-methyl-2,5-dioxopyrrolidin-3-yl)mercury
CID 142151473
3-[(2,5-dioxopyrrolidin-3-yl)sulfanyl-methylamino]sulfanyl-1-methylpyrrolidine-2,5-dione
CID 129044766
silver 1-methyl-2,5-dioxopyrrolidine-3-thiolate
CID 177217221
(1-methyl-2,5-dioxopyrrolidin-3-yl) N,N'-diethylcarbamimidothioate
CID 5338468
1-methyl-3-(5-methylidenecyclohepta-1,3,6-trien-1-yl)sulfanylpyrrolidine-2,5-dione
CID 163464251
3-(4-amino-2-fluorophenyl)sulfanyl-1-methylpyrrolidine-2,5-dione
CID 43638591
2-[(3S)-1-methyl-2,5-dioxopyrrolidin-3-yl]sulfanylbenzoic acid
CID 693728

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium?
The IUPAC name of 1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium (CID 58713838) is 1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium.
What is the SMILES notation for 1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium?
The canonical SMILES for 1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium is C[C-](S)SC1CC(=O)N(C)C1=O.[Y].
What is the InChIKey of 1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium?
The InChIKey is SRFXOLIHYAMXGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10NO2S2.Y/c1-4(11)12-5-3-6(9)8(2)7(5)10;/h5,11H,3H2,1-2H3;/q-1;.
What are the key properties of 1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium?
1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium has a molecular weight of 293.20 g/mol, XLogP of 0.91, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(1-sulfanylethylsulfanyl)pyrrolidine-2,5-dione;yttrium is sourced from PubChem (CID 58713838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).