N-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide

C12H12F2N2O2 — CID 47109120

IUPACN-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide
SMILESO=C(Nc1ccc(F)cc1F)C(=O)N1CCCC1
InChIInChI=1S/C12H12F2N2O2/c13-8-3-4-10(9(14)7-8)15-11(17)12(18)16-5-1-2-6-16/h3-4,7H,1-2,5-6H2,(H,15,17)
InChIKeyFDFYFQAEJXGBRB-UHFFFAOYSA-N
MW254.24 g/mol
LogP1.53
Rot. Bonds1

About N-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide

N-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide (PubChem CID 47109120) has the molecular formula C12H12F2N2O2 and a molecular weight of 254.24 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide
PubChem CID47109120
Molecular FormulaC12H12F2N2O2
Molecular Weight254.24 g/mol
Exact Mass254.09
IUPAC NameN-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide
SMILESO=C(Nc1ccc(F)cc1F)C(=O)N1CCCC1
InChIInChI=1S/C12H12F2N2O2/c13-8-3-4-10(9(14)7-8)15-11(17)12(18)16-5-1-2-6-16/h3-4,7H,1-2,5-6H2,(H,15,17)
InChIKeyFDFYFQAEJXGBRB-UHFFFAOYSA-N
XLogP1.53
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.24
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-(2,4-difluorophenyl)-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoacetamide
CID 44902220
N-(2,4-difluorophenyl)azepane-1-carbothioamide
CID 19654117
4-(azepane-1-carbonyl)-N-(2,4-difluorophenyl)benzamide
CID 109049185
N'-(2,4-difluorophenyl)-N-(4-pyrrolidin-1-ylphenyl)oxamide
CID 108987612
N-(2,4-dichlorophenyl)-2-oxo-2-piperidin-1-ylacetamide
CID 2194372
N-(2,4-difluorophenyl)-2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoacetamide
CID 108505775
[2-(2,4-difluoroanilino)-2-oxoethyl] pyrrolidine-1-carbodithioate
CID 7607052
2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(2,4-difluorophenyl)-2-oxoacetamide
CID 44892089
2-(2,4-difluoroanilino)-1-piperidin-1-ylethanone
CID 28582835
N-(2-bromo-4-methylphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide
CID 47335620
N-(2,5-difluorophenyl)-2-(4-ethylpiperazin-1-yl)-2-oxoacetamide
CID 108529715
N-(2-chloro-4-fluorophenyl)-2-(4-hydroxypiperidin-1-yl)-2-oxoacetamide
CID 47336644

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide (CID 47109120) is N-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide is O=C(Nc1ccc(F)cc1F)C(=O)N1CCCC1.
What is the InChIKey of N-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide?
The InChIKey is FDFYFQAEJXGBRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F2N2O2/c13-8-3-4-10(9(14)7-8)15-11(17)12(18)16-5-1-2-6-16/h3-4,7H,1-2,5-6H2,(H,15,17).
What are the key properties of N-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide?
N-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide has a molecular weight of 254.24 g/mol, XLogP of 1.53, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-2-oxo-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 47109120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).