N-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide

C22H23FN4O3 — CID 46933055

IUPACN-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide
SMILESO=C(NN1CNC(Cc2ccccc2)C1=O)C1CC(=O)N(Cc2ccc(F)cc2)C1
InChIInChI=1S/C22H23FN4O3/c23-18-8-6-16(7-9-18)12-26-13-17(11-20(26)28)21(29)25-27-14-24-19(22(27)30)10-15-4-2-1-3-5-15/h1-9,17,19,24H,10-14H2,(H,25,29)
InChIKeyLGUALVJLOCOKSR-UHFFFAOYSA-N
MW410.45 g/mol
LogP1.21
Rot. Bonds6

About N-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide

N-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide (PubChem CID 46933055) has the molecular formula C22H23FN4O3 and a molecular weight of 410.45 g/mol. Its IUPAC name is N-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide
PubChem CID46933055
Molecular FormulaC22H23FN4O3
Molecular Weight410.45 g/mol
Exact Mass410.18
IUPAC NameN-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide
SMILESO=C(NN1CNC(Cc2ccccc2)C1=O)C1CC(=O)N(Cc2ccc(F)cc2)C1
InChIInChI=1S/C22H23FN4O3/c23-18-8-6-16(7-9-18)12-26-13-17(11-20(26)28)21(29)25-27-14-24-19(22(27)30)10-15-4-2-1-3-5-15/h1-9,17,19,24H,10-14H2,(H,25,29)
InChIKeyLGUALVJLOCOKSR-UHFFFAOYSA-N
XLogP1.21
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.45
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of N-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide (CID 46933055) is N-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide is O=C(NN1CNC(Cc2ccccc2)C1=O)C1CC(=O)N(Cc2ccc(F)cc2)C1.
What is the InChIKey of N-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide?
The InChIKey is LGUALVJLOCOKSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23FN4O3/c23-18-8-6-16(7-9-18)12-26-13-17(11-20(26)28)21(29)25-27-14-24-19(22(27)30)10-15-4-2-1-3-5-15/h1-9,17,19,24H,10-14H2,(H,25,29).
What are the key properties of N-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide?
N-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide has a molecular weight of 410.45 g/mol, XLogP of 1.21, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-benzyl-5-oxoimidazolidin-1-yl)-1-[(4-fluorophenyl)methyl]-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 46933055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).