3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid

C10H9FN2O3 — CID 66666220

IUPAC3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid
SMILESO=C(O)N1CCN(c2ccc(F)cc2)C1=O
InChIInChI=1S/C10H9FN2O3/c11-7-1-3-8(4-2-7)12-5-6-13(9(12)14)10(15)16/h1-4H,5-6H2,(H,15,16)
InChIKeyZJNANFNLDNVGRE-UHFFFAOYSA-N
MW224.19 g/mol
LogP1.75
Rot. Bonds1

About 3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid

3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid (PubChem CID 66666220) has the molecular formula C10H9FN2O3 and a molecular weight of 224.19 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid.

Molecular Properties

Compound Name3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid
PubChem CID66666220
Molecular FormulaC10H9FN2O3
Molecular Weight224.19 g/mol
Exact Mass224.06
IUPAC Name3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid
SMILESO=C(O)N1CCN(c2ccc(F)cc2)C1=O
InChIInChI=1S/C10H9FN2O3/c11-7-1-3-8(4-2-7)12-5-6-13(9(12)14)10(15)16/h1-4H,5-6H2,(H,15,16)
InChIKeyZJNANFNLDNVGRE-UHFFFAOYSA-N
XLogP1.75
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.19
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid?
The IUPAC name of 3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid (CID 66666220) is 3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid.
What is the SMILES notation for 3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid?
The canonical SMILES for 3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid is O=C(O)N1CCN(c2ccc(F)cc2)C1=O.
What is the InChIKey of 3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid?
The InChIKey is ZJNANFNLDNVGRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O3/c11-7-1-3-8(4-2-7)12-5-6-13(9(12)14)10(15)16/h1-4H,5-6H2,(H,15,16).
What are the key properties of 3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid?
3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid has a molecular weight of 224.19 g/mol, XLogP of 1.75, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxylic acid is sourced from PubChem (CID 66666220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).