4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide

C20H21FN2O3 — CID 4673123

IUPAC4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide
SMILESCCOc1ccc(C(=O)N(CN2CCCC2=O)c2ccccc2F)cc1
InChIInChI=1S/C20H21FN2O3/c1-2-26-16-11-9-15(10-12-16)20(25)23(14-22-13-5-8-19(22)24)18-7-4-3-6-17(18)21/h3-4,6-7,9-12H,2,5,8,13-14H2,1H3
InChIKeyUKGXVQRUJDYDJD-UHFFFAOYSA-N
MW356.40 g/mol
LogP3.45
Rot. Bonds6

About 4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide

4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide (PubChem CID 4673123) has the molecular formula C20H21FN2O3 and a molecular weight of 356.40 g/mol. Its IUPAC name is 4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide.

Molecular Properties

Compound Name4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide
PubChem CID4673123
Molecular FormulaC20H21FN2O3
Molecular Weight356.40 g/mol
Exact Mass356.15
IUPAC Name4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide
SMILESCCOc1ccc(C(=O)N(CN2CCCC2=O)c2ccccc2F)cc1
InChIInChI=1S/C20H21FN2O3/c1-2-26-16-11-9-15(10-12-16)20(25)23(14-22-13-5-8-19(22)24)18-7-4-3-6-17(18)21/h3-4,6-7,9-12H,2,5,8,13-14H2,1H3
InChIKeyUKGXVQRUJDYDJD-UHFFFAOYSA-N
XLogP3.45
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluorophenyl)-4-methyl-3-nitro-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 4134618
N-(2-methoxyphenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 5055825
1-[2-(4-ethoxyphenyl)-2-oxoethyl]pyrrolidin-2-one
CID 62018618
2-ethoxy-N-(4-methoxyphenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 4114456
N-[(2-oxopyrrolidin-1-yl)methyl]-N,4-diphenylbenzamide
CID 4682478
4-ethoxy-N-ethyl-N-phenylbenzamide
CID 721190
N-(4-fluorophenyl)-3,4-dimethyl-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 3244651
N-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 51198675
N-(3-chloro-4-methylphenyl)-4-fluoro-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 4099523
N-[(4-ethoxyphenyl)methyl]-N-methyl-4-(2-oxopyrrolidin-1-yl)benzamide
CID 27822823
N-(2-cyanoethyl)-2-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]-N-(2-fluorophenyl)acetamide
CID 47010684
2-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-ethoxyphenyl)ethanone
CID 82050319

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
The IUPAC name of 4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide (CID 4673123) is 4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide.
What is the SMILES notation for 4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
The canonical SMILES for 4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide is CCOc1ccc(C(=O)N(CN2CCCC2=O)c2ccccc2F)cc1.
What is the InChIKey of 4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
The InChIKey is UKGXVQRUJDYDJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN2O3/c1-2-26-16-11-9-15(10-12-16)20(25)23(14-22-13-5-8-19(22)24)18-7-4-3-6-17(18)21/h3-4,6-7,9-12H,2,5,8,13-14H2,1H3.
What are the key properties of 4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide has a molecular weight of 356.40 g/mol, XLogP of 3.45, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-(2-fluorophenyl)-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide is sourced from PubChem (CID 4673123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).