potassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride

C7H12KNO2 — CID 173254266

IUPACpotassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride
SMILESCCC1(C)CC(=O)NC1=O.[H-].[K+]
InChIInChI=1S/C7H11NO2.K.H/c1-3-7(2)4-5(9)8-6(7)10;;/h3-4H2,1-2H3,(H,8,9,10);;/q;+1;-1
InChIKeyNETVYOPZQMIJIG-UHFFFAOYSA-N
MW181.28 g/mol
LogP-2.43
Rot. Bonds1

About potassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride

potassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride (PubChem CID 173254266) has the molecular formula C7H12KNO2 and a molecular weight of 181.28 g/mol. Its IUPAC name is potassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride.

Molecular Properties

Compound Namepotassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride
PubChem CID173254266
Molecular FormulaC7H12KNO2
Molecular Weight181.28 g/mol
Exact Mass181.05
IUPAC Namepotassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride
SMILESCCC1(C)CC(=O)NC1=O.[H-].[K+]
InChIInChI=1S/C7H11NO2.K.H/c1-3-7(2)4-5(9)8-6(7)10;;/h3-4H2,1-2H3,(H,8,9,10);;/q;+1;-1
InChIKeyNETVYOPZQMIJIG-UHFFFAOYSA-N
XLogP-2.43
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 5-2.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

calcium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride
CID 173338216
(3S)-3-ethyl-3-methylpiperidine-2,6-dione
CID 71423308
3-(3-aminopropyl)-3-methylpyrrolidine-2,5-dione
CID 23162784
4-ethyl-4-methyl-1,3-dihydroquinolin-2-one
CID 126504944
3-methyl-3-sulfanylpyrrolidine-2,5-dione
CID 159261890
6-tert-butyl-3-ethyl-3-methyl-1,4-dihydroquinolin-2-one
CID 166091623
sodium;5,5-diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione;hydride
CID 173031111
7,7,9,9-tetramethyl-2-azaspiro[4.5]decane-1,3-dione
CID 112682590
3-ethyl-3-methyloxolane-2,5-dione;methane
CID 157130864
4-ethyl-4-methylpyrrolidin-2-one
CID 18784903
3-ethyl-3,4,4-trimethylazetidin-2-one
CID 20715932
3-[(4Z,5Z)-5-ethylidene-3,3,6,6-tetramethyl-4-prop-2-enylidenenonyl]-3-methylpyrrolidine-2,5-dione
CID 145475215

Frequently Asked Questions

What is the IUPAC name of potassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride?
The IUPAC name of potassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride (CID 173254266) is potassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride.
What is the SMILES notation for potassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride?
The canonical SMILES for potassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride is CCC1(C)CC(=O)NC1=O.[H-].[K+].
What is the InChIKey of potassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride?
The InChIKey is NETVYOPZQMIJIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO2.K.H/c1-3-7(2)4-5(9)8-6(7)10;;/h3-4H2,1-2H3,(H,8,9,10);;/q;+1;-1.
What are the key properties of potassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride?
potassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride has a molecular weight of 181.28 g/mol, XLogP of -2.43, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;3-ethyl-3-methylpyrrolidine-2,5-dione;hydride is sourced from PubChem (CID 173254266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).