carbanide;1-ethylpyrrole-2,5-dione;manganese(2+)

C7H9MnNO2 — CID 59116237

IUPACcarbanide;1-ethylpyrrole-2,5-dione;manganese(2+)
SMILES[CH2-]CN1C(=O)C=CC1=O.[CH3-].[Mn+2]
InChIInChI=1S/C6H6NO2.CH3.Mn/c1-2-7-5(8)3-4-6(7)9;;/h3-4H,1-2H2;1H3;/q2*-1;+2
InChIKeyVOEAEIQUZOKBIS-UHFFFAOYSA-N
MW194.09 g/mol
LogP0.19
Rot. Bonds1

About carbanide;1-ethylpyrrole-2,5-dione;manganese(2+)

carbanide;1-ethylpyrrole-2,5-dione;manganese(2+) (PubChem CID 59116237) has the molecular formula C7H9MnNO2 and a molecular weight of 194.09 g/mol. Its IUPAC name is carbanide;1-ethylpyrrole-2,5-dione;manganese(2+).

Molecular Properties

Compound Namecarbanide;1-ethylpyrrole-2,5-dione;manganese(2+)
PubChem CID59116237
Molecular FormulaC7H9MnNO2
Molecular Weight194.09 g/mol
Exact Mass194.00
IUPAC Namecarbanide;1-ethylpyrrole-2,5-dione;manganese(2+)
SMILES[CH2-]CN1C(=O)C=CC1=O.[CH3-].[Mn+2]
InChIInChI=1S/C6H6NO2.CH3.Mn/c1-2-7-5(8)3-4-6(7)9;;/h3-4H,1-2H2;1H3;/q2*-1;+2
InChIKeyVOEAEIQUZOKBIS-UHFFFAOYSA-N
XLogP0.19
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.09
LogP ≤ 50.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbanide;1-ethylpyrrole-2,5-dione;manganese(2+)?
The IUPAC name of carbanide;1-ethylpyrrole-2,5-dione;manganese(2+) (CID 59116237) is carbanide;1-ethylpyrrole-2,5-dione;manganese(2+).
What is the SMILES notation for carbanide;1-ethylpyrrole-2,5-dione;manganese(2+)?
The canonical SMILES for carbanide;1-ethylpyrrole-2,5-dione;manganese(2+) is [CH2-]CN1C(=O)C=CC1=O.[CH3-].[Mn+2].
What is the InChIKey of carbanide;1-ethylpyrrole-2,5-dione;manganese(2+)?
The InChIKey is VOEAEIQUZOKBIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6NO2.CH3.Mn/c1-2-7-5(8)3-4-6(7)9;;/h3-4H,1-2H2;1H3;/q2*-1;+2.
What are the key properties of carbanide;1-ethylpyrrole-2,5-dione;manganese(2+)?
carbanide;1-ethylpyrrole-2,5-dione;manganese(2+) has a molecular weight of 194.09 g/mol, XLogP of 0.19, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;1-ethylpyrrole-2,5-dione;manganese(2+) is sourced from PubChem (CID 59116237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).