N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide

C18H17FN2O3 — CID 7563674

IUPACN-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)N[C@@H]1CC(=O)N(c2ccc(F)cc2)C1
InChIInChI=1S/C18H17FN2O3/c19-13-6-8-15(9-7-13)21-11-14(10-18(21)23)20-17(22)12-24-16-4-2-1-3-5-16/h1-9,14H,10-12H2,(H,20,22)/t14-/m1/s1
InChIKeyZETYUZHRPWOVTL-CQSZACIVSA-N
MW328.34 g/mol
LogP2.13
Rot. Bonds5

About N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide

N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide (PubChem CID 7563674) has the molecular formula C18H17FN2O3 and a molecular weight of 328.34 g/mol. Its IUPAC name is N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide
PubChem CID7563674
Molecular FormulaC18H17FN2O3
Molecular Weight328.34 g/mol
Exact Mass328.12
IUPAC NameN-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)N[C@@H]1CC(=O)N(c2ccc(F)cc2)C1
InChIInChI=1S/C18H17FN2O3/c19-13-6-8-15(9-7-13)21-11-14(10-18(21)23)20-17(22)12-24-16-4-2-1-3-5-16/h1-9,14H,10-12H2,(H,20,22)/t14-/m1/s1
InChIKeyZETYUZHRPWOVTL-CQSZACIVSA-N
XLogP2.13
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.34
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3S)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-(4-propan-2-ylphenoxy)acetamide
CID 7563716
2-(4-fluorophenoxy)-N-[1-(3-methoxyphenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 16822193
2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide
CID 7546892
2-(4-methoxyphenoxy)-N-(5-oxo-1-phenylpyrrolidin-3-yl)acetamide
CID 16822099
2-(4-fluorophenyl)-N-[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide
CID 7254979
N-[(3R)-1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide
CID 26397202
N-(5-oxo-1-phenylpyrrolidin-3-yl)-3-phenoxypropanamide
CID 110736812
2-(4-ethoxyphenoxy)-N-[(3S)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 7563476
2-(2-fluorophenoxy)-N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 16822267
2-(3-methoxyphenoxy)-N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 16822124
N-[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-2-yloxyacetamide
CID 16822122
N-[(3S)-1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]-2-phenylacetamide
CID 7255321

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide?
The IUPAC name of N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide (CID 7563674) is N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide.
What is the SMILES notation for N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide?
The canonical SMILES for N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide is O=C(COc1ccccc1)N[C@@H]1CC(=O)N(c2ccc(F)cc2)C1.
What is the InChIKey of N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide?
The InChIKey is ZETYUZHRPWOVTL-CQSZACIVSA-N. The full InChI is InChI=1S/C18H17FN2O3/c19-13-6-8-15(9-7-13)21-11-14(10-18(21)23)20-17(22)12-24-16-4-2-1-3-5-16/h1-9,14H,10-12H2,(H,20,22)/t14-/m1/s1.
What are the key properties of N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide?
N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide has a molecular weight of 328.34 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide is sourced from PubChem (CID 7563674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).