3-methyl-2-oxoimidazolidine-4-carboxylic acid

C5H8N2O3 — CID 55300151

IUPAC3-methyl-2-oxoimidazolidine-4-carboxylic acid
SMILESCN1C(=O)NCC1C(=O)O
InChIInChI=1S/C5H8N2O3/c1-7-3(4(8)9)2-6-5(7)10/h3H,2H2,1H3,(H,6,10)(H,8,9)
InChIKeyZYYGFIXCFRITFC-UHFFFAOYSA-N
MW144.13 g/mol
LogP-0.91
Rot. Bonds1

About 3-methyl-2-oxoimidazolidine-4-carboxylic acid

3-methyl-2-oxoimidazolidine-4-carboxylic acid (PubChem CID 55300151) has the molecular formula C5H8N2O3 and a molecular weight of 144.13 g/mol. Its IUPAC name is 3-methyl-2-oxoimidazolidine-4-carboxylic acid.

Molecular Properties

Compound Name3-methyl-2-oxoimidazolidine-4-carboxylic acid
PubChem CID55300151
Molecular FormulaC5H8N2O3
Molecular Weight144.13 g/mol
Exact Mass144.05
IUPAC Name3-methyl-2-oxoimidazolidine-4-carboxylic acid
SMILESCN1C(=O)NCC1C(=O)O
InChIInChI=1S/C5H8N2O3/c1-7-3(4(8)9)2-6-5(7)10/h3H,2H2,1H3,(H,6,10)(H,8,9)
InChIKeyZYYGFIXCFRITFC-UHFFFAOYSA-N
XLogP-0.91
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.13
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-oxoimidazolidine-4-carboxylic acid?
The IUPAC name of 3-methyl-2-oxoimidazolidine-4-carboxylic acid (CID 55300151) is 3-methyl-2-oxoimidazolidine-4-carboxylic acid.
What is the SMILES notation for 3-methyl-2-oxoimidazolidine-4-carboxylic acid?
The canonical SMILES for 3-methyl-2-oxoimidazolidine-4-carboxylic acid is CN1C(=O)NCC1C(=O)O.
What is the InChIKey of 3-methyl-2-oxoimidazolidine-4-carboxylic acid?
The InChIKey is ZYYGFIXCFRITFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O3/c1-7-3(4(8)9)2-6-5(7)10/h3H,2H2,1H3,(H,6,10)(H,8,9).
What are the key properties of 3-methyl-2-oxoimidazolidine-4-carboxylic acid?
3-methyl-2-oxoimidazolidine-4-carboxylic acid has a molecular weight of 144.13 g/mol, XLogP of -0.91, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-oxoimidazolidine-4-carboxylic acid is sourced from PubChem (CID 55300151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).