2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide

C20H20FN3O3 — CID 2082745

IUPAC2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide
SMILESCCC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2ccc(F)cc2)C1=O
InChIInChI=1S/C20H20FN3O3/c1-2-12-20(14-6-4-3-5-7-14)18(26)24(19(27)23-20)13-17(25)22-16-10-8-15(21)9-11-16/h3-11H,2,12-13H2,1H3,(H,22,25)(H,23,27)/t20-/m0/s1
InChIKeyZKLOVJPXEAYAJK-FQEVSTJZSA-N
MW369.40 g/mol
LogP3.01
Rot. Bonds6

About 2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide

2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide (PubChem CID 2082745) has the molecular formula C20H20FN3O3 and a molecular weight of 369.40 g/mol. Its IUPAC name is 2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide
PubChem CID2082745
Molecular FormulaC20H20FN3O3
Molecular Weight369.40 g/mol
Exact Mass369.15
IUPAC Name2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide
SMILESCCC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2ccc(F)cc2)C1=O
InChIInChI=1S/C20H20FN3O3/c1-2-12-20(14-6-4-3-5-7-14)18(26)24(19(27)23-20)13-17(25)22-16-10-8-15(21)9-11-16/h3-11H,2,12-13H2,1H3,(H,22,25)(H,23,27)/t20-/m0/s1
InChIKeyZKLOVJPXEAYAJK-FQEVSTJZSA-N
XLogP3.01
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.40
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-methylsulfanylphenyl)acetamide
CID 24566026
2-[(4R)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-ethylphenyl)acetamide
CID 2585532
2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide
CID 4081516
2-[(4R)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 2089932
N-(2-chloro-4-fluorophenyl)-2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]acetamide
CID 2703713
2-[(4R)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)acetamide
CID 41114565
2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide
CID 24683758
N-(3-acetylphenyl)-2-[(4R)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]acetamide
CID 2703685
2-[4-butyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]-N-(4-propylphenyl)acetamide
CID 24567523
N-(3-chlorophenyl)-2-[(4R)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]acetamide
CID 2585526
2-[(4R)-4-butyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[4-(difluoromethoxy)phenyl]acetamide
CID 41123926
2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-propylphenyl)acetamide
CID 24565803

Frequently Asked Questions

What is the IUPAC name of 2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide (CID 2082745) is 2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide is CCC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2ccc(F)cc2)C1=O.
What is the InChIKey of 2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide?
The InChIKey is ZKLOVJPXEAYAJK-FQEVSTJZSA-N. The full InChI is InChI=1S/C20H20FN3O3/c1-2-12-20(14-6-4-3-5-7-14)18(26)24(19(27)23-20)13-17(25)22-16-10-8-15(21)9-11-16/h3-11H,2,12-13H2,1H3,(H,22,25)(H,23,27)/t20-/m0/s1.
What are the key properties of 2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide?
2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide has a molecular weight of 369.40 g/mol, XLogP of 3.01, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 2082745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).