2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide

C19H17F3N4O4 — CID 92786478

IUPAC2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide
SMILESC[C@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NC(=O)NCC(F)(F)F)C1=O
InChIInChI=1S/C19H17F3N4O4/c1-18(13-7-6-11-4-2-3-5-12(11)8-13)15(28)26(17(30)25-18)9-14(27)24-16(29)23-10-19(20,21)22/h2-8H,9-10H2,1H3,(H,25,30)(H2,23,24,27,29)/t18-/m1/s1
InChIKeyNEUCNUHSTOMYRT-GOSISDBHSA-N
MW422.36 g/mol
LogP1.99
Rot. Bonds4

About 2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide

2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide (PubChem CID 92786478) has the molecular formula C19H17F3N4O4 and a molecular weight of 422.36 g/mol. Its IUPAC name is 2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide
PubChem CID92786478
Molecular FormulaC19H17F3N4O4
Molecular Weight422.36 g/mol
Exact Mass422.12
IUPAC Name2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide
SMILESC[C@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NC(=O)NCC(F)(F)F)C1=O
InChIInChI=1S/C19H17F3N4O4/c1-18(13-7-6-11-4-2-3-5-12(11)8-13)15(28)26(17(30)25-18)9-14(27)24-16(29)23-10-19(20,21)22/h2-8H,9-10H2,1H3,(H,25,30)(H2,23,24,27,29)/t18-/m1/s1
InChIKeyNEUCNUHSTOMYRT-GOSISDBHSA-N
XLogP1.99
TPSA107.61 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.36
LogP ≤ 51.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(4R)-4-(6-methoxynaphthalen-2-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 2477643
2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 2459874
N-[(4-fluorophenyl)methyl]-2-(4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 16546321
2-[(4S)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2-methylpropyl)acetamide
CID 51446549
N-[(2-fluorophenyl)methyl]-2-(4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 18170358
2-[(4S)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2371043
N-(benzylcarbamoyl)-3-(4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl)propanamide
CID 24592825
methyl 2-methyl-2-[[2-(4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl)acetyl]amino]propanoate
CID 55600305
N-(2,2-dimethylpropyl)-2-(4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 56531093
2-[(4S)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-naphthalen-1-ylacetamide
CID 41183201
2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(4-phenoxyphenyl)acetamide
CID 25436664
(5R)-3-[2-(azepan-1-yl)-2-oxoethyl]-5-methyl-5-naphthalen-2-ylimidazolidine-2,4-dione
CID 2526606

Frequently Asked Questions

What is the IUPAC name of 2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide?
The IUPAC name of 2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide (CID 92786478) is 2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide.
What is the SMILES notation for 2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide?
The canonical SMILES for 2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide is C[C@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NC(=O)NCC(F)(F)F)C1=O.
What is the InChIKey of 2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide?
The InChIKey is NEUCNUHSTOMYRT-GOSISDBHSA-N. The full InChI is InChI=1S/C19H17F3N4O4/c1-18(13-7-6-11-4-2-3-5-12(11)8-13)15(28)26(17(30)25-18)9-14(27)24-16(29)23-10-19(20,21)22/h2-8H,9-10H2,1H3,(H,25,30)(H2,23,24,27,29)/t18-/m1/s1.
What are the key properties of 2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide?
2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide has a molecular weight of 422.36 g/mol, XLogP of 1.99, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide is sourced from PubChem (CID 92786478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).