[1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate

C20H19FN2O5 — CID 18091092

IUPAC[1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate
SMILESCC(OC(=O)c1ccccc1OCc1ccc(F)cc1)C(=O)N1CCNC1=O
InChIInChI=1S/C20H19FN2O5/c1-13(18(24)23-11-10-22-20(23)26)28-19(25)16-4-2-3-5-17(16)27-12-14-6-8-15(21)9-7-14/h2-9,13H,10-12H2,1H3,(H,22,26)
InChIKeyORIFPWFFONODPG-UHFFFAOYSA-N
MW386.38 g/mol
LogP2.50
Rot. Bonds6

About [1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate

[1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate (PubChem CID 18091092) has the molecular formula C20H19FN2O5 and a molecular weight of 386.38 g/mol. Its IUPAC name is [1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate.

Molecular Properties

Compound Name[1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate
PubChem CID18091092
Molecular FormulaC20H19FN2O5
Molecular Weight386.38 g/mol
Exact Mass386.13
IUPAC Name[1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate
SMILESCC(OC(=O)c1ccccc1OCc1ccc(F)cc1)C(=O)N1CCNC1=O
InChIInChI=1S/C20H19FN2O5/c1-13(18(24)23-11-10-22-20(23)26)28-19(25)16-4-2-3-5-17(16)27-12-14-6-8-15(21)9-7-14/h2-9,13H,10-12H2,1H3,(H,22,26)
InChIKeyORIFPWFFONODPG-UHFFFAOYSA-N
XLogP2.50
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.38
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate with MolForge

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Related Compounds

Methyl 2-[2-hydroxy-3-[[2-methyl-1-(morpholine-4-carbonylamino)propan-2-yl]amino]propoxy]benzoate
CID 13732865
[2-(Cyclohexylmethylamino)-2-oxoethyl] 2-ethoxybenzoate
CID 2636785
[1-(Cyclopropylamino)-1-oxopropan-2-yl] 2-phenoxybenzoate
CID 4877306
Methyl 2-[2-(cyclohexylamino)-2-oxoethoxy]benzoate
CID 891719
[2-(Carbamoylamino)-2-oxoethyl] 2-phenoxybenzoate
CID 2116753
[2-[2-(4-Methoxyphenyl)ethylamino]-2-oxoethyl] 2-ethoxybenzoate
CID 2344906
[2-Oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-phenoxybenzoate
CID 2497261
[2-(Cyclopropylamino)-2-oxoethyl] 2-phenoxybenzoate
CID 2553980
[2-(Cyclopentylcarbamoylamino)-2-oxoethyl] 2-methoxybenzoate
CID 2627797
[2-Oxo-2-(4-phenylbutan-2-ylamino)ethyl] 2-methoxybenzoate
CID 3462492
(2-Morpholin-4-yl-2-oxoethyl) 2-[(4-fluorophenyl)methoxy]benzoate
CID 9114492
[2-(Cyclohexylcarbamoylamino)-2-oxoethyl] 2-methoxybenzoate
CID 2634327

Frequently Asked Questions

What is the IUPAC name of [1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate?
The IUPAC name of [1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate (CID 18091092) is [1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate.
What is the SMILES notation for [1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate?
The canonical SMILES for [1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate is CC(OC(=O)c1ccccc1OCc1ccc(F)cc1)C(=O)N1CCNC1=O.
What is the InChIKey of [1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate?
The InChIKey is ORIFPWFFONODPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN2O5/c1-13(18(24)23-11-10-22-20(23)26)28-19(25)16-4-2-3-5-17(16)27-12-14-6-8-15(21)9-7-14/h2-9,13H,10-12H2,1H3,(H,22,26).
What are the key properties of [1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate?
[1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate has a molecular weight of 386.38 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-[(4-fluorophenyl)methoxy]benzoate is sourced from PubChem (CID 18091092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).