ethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid

C6H11N2O5P — CID 140810948

IUPACethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid
SMILESCCOP(=O)(O)N1C(=O)CN(C)C1=O
InChIInChI=1S/C6H11N2O5P/c1-3-13-14(11,12)8-5(9)4-7(2)6(8)10/h3-4H2,1-2H3,(H,11,12)
InChIKeyXYRXHCZCCJOGGU-UHFFFAOYSA-N
MW222.14 g/mol
LogP0.02
Rot. Bonds3

About ethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid

ethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid (PubChem CID 140810948) has the molecular formula C6H11N2O5P and a molecular weight of 222.14 g/mol. Its IUPAC name is ethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid.

Molecular Properties

Compound Nameethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid
PubChem CID140810948
Molecular FormulaC6H11N2O5P
Molecular Weight222.14 g/mol
Exact Mass222.04
IUPAC Nameethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid
SMILESCCOP(=O)(O)N1C(=O)CN(C)C1=O
InChIInChI=1S/C6H11N2O5P/c1-3-13-14(11,12)8-5(9)4-7(2)6(8)10/h3-4H2,1-2H3,(H,11,12)
InChIKeyXYRXHCZCCJOGGU-UHFFFAOYSA-N
XLogP0.02
TPSA87.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.14
LogP ≤ 50.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2,5-dioxopyrrol-1-yl)-ethoxyphosphinic acid
CID 140811010
ethane;3-ethyl-1-methylimidazolidine-2,4-dione
CID 142101907
1,4,7-trimethyl-1,4,7-triazonane-2,5,8-trione
CID 71358039
alumane;tris(ethyl dihydrogen phosphate)
CID 173189565
copper;diethyl hydrogen phosphate
CID 174593393
diethyl hydrogen phosphate;phosphoric acid
CID 87753541
alumane;ethyl dihydrogen phosphate
CID 173113989
CID 54611578
CID 54611578
diethyl hydrogen phosphate;sulfane
CID 88774651
azane;bis(ethyl dihydrogen phosphate)
CID 174611775
diethyl hydrogen phosphate;scandium
CID 54607585
diethyl hydrogen phosphate;1,3-dimethyl-2H-imidazole
CID 162039281

Frequently Asked Questions

What is the IUPAC name of ethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid?
The IUPAC name of ethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid (CID 140810948) is ethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid.
What is the SMILES notation for ethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid?
The canonical SMILES for ethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid is CCOP(=O)(O)N1C(=O)CN(C)C1=O.
What is the InChIKey of ethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid?
The InChIKey is XYRXHCZCCJOGGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N2O5P/c1-3-13-14(11,12)8-5(9)4-7(2)6(8)10/h3-4H2,1-2H3,(H,11,12).
What are the key properties of ethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid?
ethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid has a molecular weight of 222.14 g/mol, XLogP of 0.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-(3-methyl-2,5-dioxoimidazolidin-1-yl)phosphinic acid is sourced from PubChem (CID 140810948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).