N-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide

C19H20N2O3 — CID 3693269

IUPACN-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESCCOc1ccc(NC(=O)C2CC(=O)N(c3ccccc3)C2)cc1
InChIInChI=1S/C19H20N2O3/c1-2-24-17-10-8-15(9-11-17)20-19(23)14-12-18(22)21(13-14)16-6-4-3-5-7-16/h3-11,14H,2,12-13H2,1H3,(H,20,23)
InChIKeyNXWFXRFPBWXXBV-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.08
Rot. Bonds5

About N-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide

N-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide (PubChem CID 3693269) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
PubChem CID3693269
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC NameN-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESCCOc1ccc(NC(=O)C2CC(=O)N(c3ccccc3)C2)cc1
InChIInChI=1S/C19H20N2O3/c1-2-24-17-10-8-15(9-11-17)20-19(23)14-12-18(22)21(13-14)16-6-4-3-5-7-16/h3-11,14H,2,12-13H2,1H3,(H,20,23)
InChIKeyNXWFXRFPBWXXBV-UHFFFAOYSA-N
XLogP3.08
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 ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-1-(4-ethoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 3342359
(3S)-1-(4-ethoxyphenyl)-N-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 988212
(3R)-1-(4-ethoxyphenyl)-N-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 988215
(3S)-N-(4-ethoxyphenyl)-5-oxo-1-(4-propoxyphenyl)pyrrolidine-3-carboxamide
CID 7325492
(3R)-1-(4-ethoxyphenyl)-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide
CID 1088301
5-oxo-1-phenyl-N-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide
CID 17080562
N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 55610242
1-(4-ethoxyphenyl)-5-oxo-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-3-carboxamide
CID 17498477
(3R)-1-(4-ethoxyphenyl)-N-(4-morpholin-4-ylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 1006945
(3S)-1-(4-ethoxyphenyl)-N-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 1072645
(3R)-1-(4-ethoxyphenyl)-N-[4-(ethylsulfamoyl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 41002488
(3R)-N-[4-(diethylsulfamoyl)phenyl]-1-(4-ethoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 40964253

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The IUPAC name of N-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide (CID 3693269) is N-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide is CCOc1ccc(NC(=O)C2CC(=O)N(c3ccccc3)C2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The InChIKey is NXWFXRFPBWXXBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-2-24-17-10-8-15(9-11-17)20-19(23)14-12-18(22)21(13-14)16-6-4-3-5-7-16/h3-11,14H,2,12-13H2,1H3,(H,20,23).
What are the key properties of N-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide?
N-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide is sourced from PubChem (CID 3693269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).