(2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate

C14H16FNO4 — CID 23885124

IUPAC(2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate
SMILESO=C(COc1ccccc1F)OCC(=O)N1CCCC1
InChIInChI=1S/C14H16FNO4/c15-11-5-1-2-6-12(11)19-10-14(18)20-9-13(17)16-7-3-4-8-16/h1-2,5-6H,3-4,7-10H2
InChIKeyFUUGVQZPEKBCTG-UHFFFAOYSA-N
MW281.28 g/mol
LogP1.37
Rot. Bonds5

About (2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate

(2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate (PubChem CID 23885124) has the molecular formula C14H16FNO4 and a molecular weight of 281.28 g/mol. Its IUPAC name is (2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate.

Molecular Properties

Compound Name(2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate
PubChem CID23885124
Molecular FormulaC14H16FNO4
Molecular Weight281.28 g/mol
Exact Mass281.11
IUPAC Name(2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate
SMILESO=C(COc1ccccc1F)OCC(=O)N1CCCC1
InChIInChI=1S/C14H16FNO4/c15-11-5-1-2-6-12(11)19-10-14(18)20-9-13(17)16-7-3-4-8-16/h1-2,5-6H,3-4,7-10H2
InChIKeyFUUGVQZPEKBCTG-UHFFFAOYSA-N
XLogP1.37
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.28
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl] 2-(2-fluorophenoxy)acetate
CID 7842352
(3S)-1-[2-(2-fluorophenoxy)acetyl]piperidine-3-carboxylic acid
CID 81125518
(2-oxo-2-phenothiazin-10-ylethyl) 2-(2-fluorophenoxy)acetate
CID 7842440
4-[2-(2-fluorophenoxy)acetyl]-N-propan-2-yl-1,4-diazepane-1-carboxamide
CID 110811892
2-(2-fluorophenoxy)-1-[4-(6-piperidin-1-ylpyridazin-3-yl)piperazin-1-yl]ethanone
CID 122334635
1-(4-cyclopropylpiperazin-1-yl)-2-(2-fluorophenoxy)ethanone
CID 110708570
N-tert-butyl-4-[2-(2-fluorophenoxy)acetyl]-1,4-diazepane-1-carboxamide
CID 110811893
[2-(azepan-1-yl)-2-oxoethyl] 2-(4-chlorophenoxy)acetate
CID 2355354
2-[2-(azetidin-1-yl)-2-oxoethoxy]-6-fluorobenzoic acid
CID 107014105
1-(2,2-difluoro-6-azaspiro[2.5]octan-6-yl)-2-(2-fluorophenoxy)ethanone
CID 131702362
2-(2-fluorophenoxy)-1-(3-hydroxy-3-methylpiperidin-1-yl)ethanone
CID 115875253
2-(4-amino-2-fluorophenoxy)-1-(azepan-1-yl)ethanone
CID 43259286

Frequently Asked Questions

What is the IUPAC name of (2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate?
The IUPAC name of (2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate (CID 23885124) is (2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate.
What is the SMILES notation for (2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate?
The canonical SMILES for (2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate is O=C(COc1ccccc1F)OCC(=O)N1CCCC1.
What is the InChIKey of (2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate?
The InChIKey is FUUGVQZPEKBCTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FNO4/c15-11-5-1-2-6-12(11)19-10-14(18)20-9-13(17)16-7-3-4-8-16/h1-2,5-6H,3-4,7-10H2.
What are the key properties of (2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate?
(2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate has a molecular weight of 281.28 g/mol, XLogP of 1.37, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-oxo-2-pyrrolidin-1-ylethyl) 2-(2-fluorophenoxy)acetate is sourced from PubChem (CID 23885124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).