N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide

C13H15FN2O2 — CID 43971095

IUPACN-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide
SMILESCCC(=O)NC1CC(=O)N(c2cccc(F)c2)C1
InChIInChI=1S/C13H15FN2O2/c1-2-12(17)15-10-7-13(18)16(8-10)11-5-3-4-9(14)6-11/h3-6,10H,2,7-8H2,1H3,(H,15,17)
InChIKeyULGADOBOZOTFHW-UHFFFAOYSA-N
MW250.27 g/mol
LogP1.46
Rot. Bonds3

About N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide

N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide (PubChem CID 43971095) has the molecular formula C13H15FN2O2 and a molecular weight of 250.27 g/mol. Its IUPAC name is N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide.

Molecular Properties

Compound NameN-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide
PubChem CID43971095
Molecular FormulaC13H15FN2O2
Molecular Weight250.27 g/mol
Exact Mass250.11
IUPAC NameN-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide
SMILESCCC(=O)NC1CC(=O)N(c2cccc(F)c2)C1
InChIInChI=1S/C13H15FN2O2/c1-2-12(17)15-10-7-13(18)16(8-10)11-5-3-4-9(14)6-11/h3-6,10H,2,7-8H2,1H3,(H,15,17)
InChIKeyULGADOBOZOTFHW-UHFFFAOYSA-N
XLogP1.46
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.27
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-N-[(3S)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 7563337
N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-phenylacetamide
CID 43971138
1-ethyl-3-[(3S)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]urea
CID 7546969
1-[(2R)-butan-2-yl]-3-[(3S)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]urea
CID 7546996
2-(4-ethoxyphenoxy)-N-[(3S)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 7563476
ethyl 4-[[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]carbamoyl]piperazine-1-carboxylate
CID 7546926
N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-2-(2-methoxyphenoxy)acetamide
CID 16822262
N-[2-[[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]carbamoylamino]ethyl]acetamide
CID 18564403
1-cyclopentyl-3-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]urea
CID 43970168
3-(1,3-dioxoisoindol-2-yl)-N-[(3R)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide
CID 7563558
3-(1,3-dioxoisoindol-2-yl)-N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide
CID 43971149
2-(2-fluorophenoxy)-N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 16822267

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide?
The IUPAC name of N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide (CID 43971095) is N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide.
What is the SMILES notation for N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide?
The canonical SMILES for N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide is CCC(=O)NC1CC(=O)N(c2cccc(F)c2)C1.
What is the InChIKey of N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide?
The InChIKey is ULGADOBOZOTFHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN2O2/c1-2-12(17)15-10-7-13(18)16(8-10)11-5-3-4-9(14)6-11/h3-6,10H,2,7-8H2,1H3,(H,15,17).
What are the key properties of N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide?
N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide has a molecular weight of 250.27 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide is sourced from PubChem (CID 43971095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).