azanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+)

C11H16N2O5Y+ — CID 20683205

IUPACazanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+)
SMILESCC([C-]=O)CC(C)C(=O)ON1C(=O)CCC1=O.[NH2-].[Y+3]
InChIInChI=1S/C11H14NO5.H2N.Y/c1-7(6-13)5-8(2)11(16)17-12-9(14)3-4-10(12)15;;/h7-8H,3-5H2,1-2H3;1H2;/q2*-1;+3
InChIKeyOJEKAZKYUPTHNB-UHFFFAOYSA-N
MW345.16 g/mol
LogP1.08
Rot. Bonds5

About azanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+)

azanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+) (PubChem CID 20683205) has the molecular formula C11H16N2O5Y+ and a molecular weight of 345.16 g/mol. Its IUPAC name is azanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+).

Molecular Properties

Compound Nameazanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+)
PubChem CID20683205
Molecular FormulaC11H16N2O5Y+
Molecular Weight345.16 g/mol
Exact Mass345.01
IUPAC Nameazanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+)
SMILESCC([C-]=O)CC(C)C(=O)ON1C(=O)CCC1=O.[NH2-].[Y+3]
InChIInChI=1S/C11H14NO5.H2N.Y/c1-7(6-13)5-8(2)11(16)17-12-9(14)3-4-10(12)15;;/h7-8H,3-5H2,1-2H3;1H2;/q2*-1;+3
InChIKeyOJEKAZKYUPTHNB-UHFFFAOYSA-N
XLogP1.08
TPSA114.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.16
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(2,5-dioxopyrrolidin-1-yl) 2-methylpentanoate
CID 11206648
bis(2,5-dioxopyrrolidin-1-yl) (2S)-2-methylpentanedioate
CID 58472277
(2,5-dioxopyrrolidin-1-yl) (2S)-2,4-diamino-4-oxobutanoate
CID 130454141
(2,5-dioxopyrrolidin-1-yl) 5-amino-2,4-dimethyl-3-oxopentanoate
CID 88872212
2-chloro-3-methylbutane;(2,5-dioxopyrrolidin-1-yl) 2-methylpropanoate
CID 158531615
(2,5-dioxopyrrolidin-1-yl) (2S)-2-acetyloxypropanoate
CID 122671324
(2,5-dioxopyrrolidin-1-yl) 2-methylpropyl carbonate
CID 19911288
(2,5-dioxopyrrolidin-1-yl) 4-[1,3-bis(methylcarbamoyloxy)propan-2-yloxy]-2-methylbutanoate
CID 88925927
(2,5-dioxopyrrolidin-1-yl) 3-(4-hydroxyphenoxy)-2-methylpropanoate;ethane
CID 143259221
(2,5-dioxopyrrolidin-1-yl) [(2,5-dioxopyrrolidin-1-yl)oxycarbonyloxymethyldisulfanyl]methyl carbonate
CID 90051305
bis(2,5-dioxopyrrolidin-1-yl) 2-acetamidobutanedioate
CID 147117897
(2,5-dioxopyrrolidin-1-yl) 4-[3-(2,5-dioxopyrrolidin-1-yl)oxy-2-methyl-3-oxopropoxy]-2-methylbut-2-enoate
CID 76674165

Frequently Asked Questions

What is the IUPAC name of azanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+)?
The IUPAC name of azanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+) (CID 20683205) is azanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+).
What is the SMILES notation for azanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+)?
The canonical SMILES for azanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+) is CC([C-]=O)CC(C)C(=O)ON1C(=O)CCC1=O.[NH2-].[Y+3].
What is the InChIKey of azanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+)?
The InChIKey is OJEKAZKYUPTHNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14NO5.H2N.Y/c1-7(6-13)5-8(2)11(16)17-12-9(14)3-4-10(12)15;;/h7-8H,3-5H2,1-2H3;1H2;/q2*-1;+3.
What are the key properties of azanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+)?
azanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+) has a molecular weight of 345.16 g/mol, XLogP of 1.08, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azanide;(2,5-dioxopyrrolidin-1-yl) 2,4-dimethyl-5-oxopentanoate;yttrium(3+) is sourced from PubChem (CID 20683205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).