carbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium

C9H7NO2Y-2 — CID 58201746

IUPACcarbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium
SMILESO=C1Nc2cc[c-]cc2C1=O.[CH3-].[Y]
InChIInChI=1S/C8H4NO2.CH3.Y/c10-7-5-3-1-2-4-6(5)9-8(7)11;;/h2-4H,(H,9,10,11);1H3;/q2*-1;
InChIKeyXXEDVYVUNCEUAU-UHFFFAOYSA-N
MW250.07 g/mol
LogP1.07
Rot. Bonds

About carbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium

carbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium (PubChem CID 58201746) has the molecular formula C9H7NO2Y-2 and a molecular weight of 250.07 g/mol. Its IUPAC name is carbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium.

Molecular Properties

Compound Namecarbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium
PubChem CID58201746
Molecular FormulaC9H7NO2Y-2
Molecular Weight250.07 g/mol
Exact Mass249.95
IUPAC Namecarbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium
SMILESO=C1Nc2cc[c-]cc2C1=O.[CH3-].[Y]
InChIInChI=1S/C8H4NO2.CH3.Y/c10-7-5-3-1-2-4-6(5)9-8(7)11;;/h2-4H,(H,9,10,11);1H3;/q2*-1;
InChIKeyXXEDVYVUNCEUAU-UHFFFAOYSA-N
XLogP1.07
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.07
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium?
The IUPAC name of carbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium (CID 58201746) is carbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium.
What is the SMILES notation for carbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium?
The canonical SMILES for carbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium is O=C1Nc2cc[c-]cc2C1=O.[CH3-].[Y].
What is the InChIKey of carbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium?
The InChIKey is XXEDVYVUNCEUAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4NO2.CH3.Y/c10-7-5-3-1-2-4-6(5)9-8(7)11;;/h2-4H,(H,9,10,11);1H3;/q2*-1;.
What are the key properties of carbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium?
carbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium has a molecular weight of 250.07 g/mol, XLogP of 1.07, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium is sourced from PubChem (CID 58201746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).