N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide

C23H17ClF3N3O3 — CID 42964336

IUPACN-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide
SMILESCC1(c2cccc3ccccc23)NC(=O)N(CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1=O
InChIInChI=1S/C23H17ClF3N3O3/c1-22(16-8-4-6-13-5-2-3-7-15(13)16)20(32)30(21(33)29-22)12-19(31)28-14-9-10-18(24)17(11-14)23(25,26)27/h2-11H,12H2,1H3,(H,28,31)(H,29,33)
InChIKeyHMMBZPWNQDAUFA-UHFFFAOYSA-N
MW475.85 g/mol
LogP4.92
Rot. Bonds4

About N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide

N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide (PubChem CID 42964336) has the molecular formula C23H17ClF3N3O3 and a molecular weight of 475.85 g/mol. Its IUPAC name is N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide
PubChem CID42964336
Molecular FormulaC23H17ClF3N3O3
Molecular Weight475.85 g/mol
Exact Mass475.09
IUPAC NameN-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide
SMILESCC1(c2cccc3ccccc23)NC(=O)N(CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1=O
InChIInChI=1S/C23H17ClF3N3O3/c1-22(16-8-4-6-13-5-2-3-7-15(13)16)20(32)30(21(33)29-22)12-19(31)28-14-9-10-18(24)17(11-14)23(25,26)27/h2-11H,12H2,1H3,(H,28,31)(H,29,33)
InChIKeyHMMBZPWNQDAUFA-UHFFFAOYSA-N
XLogP4.92
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500475.85
LogP ≤ 54.92
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

N-(3-chlorophenyl)-2-[(4S)-4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7242878
2-[(4R)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide
CID 41167125
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 42989218
N-(3-acetylphenyl)-2-[(4R)-4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7180056
N-(2-chlorophenyl)-2-[(4R)-4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7180066
N-(3-cyanophenyl)-2-[(4R)-4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7180072
N-(3-ethylphenyl)-2-[(4R)-4-methyl-2,5-dioxo-4-[2-(trifluoromethyl)phenyl]imidazolidin-1-yl]acetamide
CID 51951293
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(4S)-2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl]acetamide
CID 2449152
2-[(4S)-4-(2-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(3-fluorophenyl)acetamide
CID 2582941
N-(3-chlorophenyl)-2-[(4R)-4-(2-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2702241
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 7916465
N-(2,6-dimethylphenyl)-2-[(4R)-4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7242865

Frequently Asked Questions

What is the IUPAC name of N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide?
The IUPAC name of N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide (CID 42964336) is N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide.
What is the SMILES notation for N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide?
The canonical SMILES for N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide is CC1(c2cccc3ccccc23)NC(=O)N(CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1=O.
What is the InChIKey of N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide?
The InChIKey is HMMBZPWNQDAUFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17ClF3N3O3/c1-22(16-8-4-6-13-5-2-3-7-15(13)16)20(32)30(21(33)29-22)12-19(31)28-14-9-10-18(24)17(11-14)23(25,26)27/h2-11H,12H2,1H3,(H,28,31)(H,29,33).
What are the key properties of N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide?
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide has a molecular weight of 475.85 g/mol, XLogP of 4.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide is sourced from PubChem (CID 42964336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).