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

C8H4NO2Y- — CID 59896938

IUPAC1,5-dihydroindol-5-ide-2,3-dione;yttrium
SMILESO=C1Nc2cc[c-]cc2C1=O.[Y]
InChIInChI=1S/C8H4NO2.Y/c10-7-5-3-1-2-4-6(5)9-8(7)11;/h2-4H,(H,9,10,11);/q-1;
InChIKeyTYDMYFNEMVMFRA-UHFFFAOYSA-N
MW235.03 g/mol
LogP0.62
Rot. Bonds

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

1,5-dihydroindol-5-ide-2,3-dione;yttrium (PubChem CID 59896938) has the molecular formula C8H4NO2Y- and a molecular weight of 235.03 g/mol. Its IUPAC name is 1,5-dihydroindol-5-ide-2,3-dione;yttrium.

Molecular Properties

Compound Name1,5-dihydroindol-5-ide-2,3-dione;yttrium
PubChem CID59896938
Molecular FormulaC8H4NO2Y-
Molecular Weight235.03 g/mol
Exact Mass234.93
IUPAC Name1,5-dihydroindol-5-ide-2,3-dione;yttrium
SMILESO=C1Nc2cc[c-]cc2C1=O.[Y]
InChIInChI=1S/C8H4NO2.Y/c10-7-5-3-1-2-4-6(5)9-8(7)11;/h2-4H,(H,9,10,11);/q-1;
InChIKeyTYDMYFNEMVMFRA-UHFFFAOYSA-N
XLogP0.62
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.03
LogP ≤ 50.62
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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Related Compounds

2,5,8(1H)-Quinolinetrione
CID 267592
4-methyl-1H-quinoline-2,5,8-trione
CID 10921303
4-Methylidene-1,5-dihydroindole-2,3-dione
CID 70398209
Cyclopenta[b]pyridin-2,5-dione
CID 117834443
4-[(E)-2-fluoroethenyl]-5-[(Z)-prop-1-enyl]-1H-pyrrole-2,3-dione
CID 143920343
3-ethyl-1H-quinoline-2,5,8-trione
CID 10856574
Quinolone-3 (5h)-one
CID 129676565
3-Ethyl-4-methyl-2,7-dihydrocyclopenta[c]pyridin-1-one
CID 20720242
6,7-dihydro-1H-cyclopenta[b]pyridine-2,5-dione
CID 57325676
6-Methyl-1,5-dihydroindol-5-ide-2,3-dione;yttrium
CID 57566048
1,5-Dihydrocyclopenta[b]pyridine-2,4-dione
CID 58191074
Carbanide;1,5-dihydroindol-5-ide-2,3-dione;yttrium
CID 58201746

Frequently Asked Questions

What is the IUPAC name of 1,5-dihydroindol-5-ide-2,3-dione;yttrium?
The IUPAC name of 1,5-dihydroindol-5-ide-2,3-dione;yttrium (CID 59896938) is 1,5-dihydroindol-5-ide-2,3-dione;yttrium.
What is the SMILES notation for 1,5-dihydroindol-5-ide-2,3-dione;yttrium?
The canonical SMILES for 1,5-dihydroindol-5-ide-2,3-dione;yttrium is O=C1Nc2cc[c-]cc2C1=O.[Y].
What is the InChIKey of 1,5-dihydroindol-5-ide-2,3-dione;yttrium?
The InChIKey is TYDMYFNEMVMFRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4NO2.Y/c10-7-5-3-1-2-4-6(5)9-8(7)11;/h2-4H,(H,9,10,11);/q-1;.
What are the key properties of 1,5-dihydroindol-5-ide-2,3-dione;yttrium?
1,5-dihydroindol-5-ide-2,3-dione;yttrium has a molecular weight of 235.03 g/mol, XLogP of 0.62, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dihydroindol-5-ide-2,3-dione;yttrium is sourced from PubChem (CID 59896938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).