2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide

C20H22N2O4 — CID 7546892

IUPAC2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide
SMILESCCOc1ccc(OCC(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)cc1
InChIInChI=1S/C20H22N2O4/c1-2-25-17-8-10-18(11-9-17)26-14-19(23)21-15-12-20(24)22(13-15)16-6-4-3-5-7-16/h3-11,15H,2,12-14H2,1H3,(H,21,23)/t15-/m0/s1
InChIKeyNOGZMHANKZJOKM-HNNXBMFYSA-N
MW354.41 g/mol
LogP2.39
Rot. Bonds7

About 2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide

2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide (PubChem CID 7546892) has the molecular formula C20H22N2O4 and a molecular weight of 354.41 g/mol. Its IUPAC name is 2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide.

Molecular Properties

Compound Name2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide
PubChem CID7546892
Molecular FormulaC20H22N2O4
Molecular Weight354.41 g/mol
Exact Mass354.16
IUPAC Name2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide
SMILESCCOc1ccc(OCC(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)cc1
InChIInChI=1S/C20H22N2O4/c1-2-25-17-8-10-18(11-9-17)26-14-19(23)21-15-12-20(24)22(13-15)16-6-4-3-5-7-16/h3-11,15H,2,12-14H2,1H3,(H,21,23)/t15-/m0/s1
InChIKeyNOGZMHANKZJOKM-HNNXBMFYSA-N
XLogP2.39
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methoxyphenoxy)-N-(5-oxo-1-phenylpyrrolidin-3-yl)acetamide
CID 16822099
N-[(3S)-1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]-2-phenylacetamide
CID 7255321
2-(4-ethoxyphenoxy)-N-[(3S)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 7563476
N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenoxyacetamide
CID 7563674
N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide
CID 43971034
2-chloro-N-[(3R)-1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 7548875
2-chloro-N-[(3S)-1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 7548879
N-[(3S)-1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]-4-phenylbutanamide
CID 7563275
3-chloro-N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]propanamide
CID 43971031
N-[(3R)-1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]pentanamide
CID 7548852
N-[(3R)-1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]-2-naphthalen-1-ylacetamide
CID 7255326
methyl N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]carbamate
CID 43971090

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide?
The IUPAC name of 2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide (CID 7546892) is 2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide.
What is the SMILES notation for 2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide?
The canonical SMILES for 2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide is CCOc1ccc(OCC(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)cc1.
What is the InChIKey of 2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide?
The InChIKey is NOGZMHANKZJOKM-HNNXBMFYSA-N. The full InChI is InChI=1S/C20H22N2O4/c1-2-25-17-8-10-18(11-9-17)26-14-19(23)21-15-12-20(24)22(13-15)16-6-4-3-5-7-16/h3-11,15H,2,12-14H2,1H3,(H,21,23)/t15-/m0/s1.
What are the key properties of 2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide?
2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide has a molecular weight of 354.41 g/mol, XLogP of 2.39, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide is sourced from PubChem (CID 7546892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).