N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide

C19H20N2O3 — CID 43971034

IUPACN-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide
SMILESCCOc1ccc(N2CC(NC(=O)c3ccccc3)CC2=O)cc1
InChIInChI=1S/C19H20N2O3/c1-2-24-17-10-8-16(9-11-17)21-13-15(12-18(21)22)20-19(23)14-6-4-3-5-7-14/h3-11,15H,2,12-13H2,1H3,(H,20,23)
InChIKeyGLUSQVPVTMNHEU-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.62
Rot. Bonds5

About N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide

N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide (PubChem CID 43971034) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide.

Molecular Properties

Compound NameN-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide
PubChem CID43971034
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC NameN-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide
SMILESCCOc1ccc(N2CC(NC(=O)c3ccccc3)CC2=O)cc1
InChIInChI=1S/C19H20N2O3/c1-2-24-17-10-8-16(9-11-17)21-13-15(12-18(21)22)20-19(23)14-6-4-3-5-7-14/h3-11,15H,2,12-13H2,1H3,(H,20,23)
InChIKeyGLUSQVPVTMNHEU-UHFFFAOYSA-N
XLogP2.62
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethoxy-N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide
CID 43971041
N-[1-(4-chlorophenyl)-5-oxopyrrolidin-3-yl]-4-ethoxybenzamide
CID 16822308
N-[(3S)-1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]-3-methylbenzamide
CID 7548914
N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]-3-methylbenzamide
CID 16822230
4-butoxy-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide
CID 7546724
N-[(3S)-1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]-2-phenylacetamide
CID 7255321
N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]-3-(trifluoromethyl)benzamide
CID 16822243
2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide
CID 7546892
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-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]-2,6-difluorobenzamide
CID 16822238
methyl N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]carbamate
CID 43971090

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide?
The IUPAC name of N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide (CID 43971034) is N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide.
What is the SMILES notation for N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide?
The canonical SMILES for N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide is CCOc1ccc(N2CC(NC(=O)c3ccccc3)CC2=O)cc1.
What is the InChIKey of N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide?
The InChIKey is GLUSQVPVTMNHEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-2-24-17-10-8-16(9-11-17)21-13-15(12-18(21)22)20-19(23)14-6-4-3-5-7-14/h3-11,15H,2,12-13H2,1H3,(H,20,23).
What are the key properties of N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide?
N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide has a molecular weight of 324.38 g/mol, XLogP of 2.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide is sourced from PubChem (CID 43971034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).