2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide

C18H20F3N3O3 — CID 4145120

IUPAC2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
SMILESCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1cccc(C(F)(F)F)c1)C2=O
InChIInChI=1S/C18H20F3N3O3/c1-11-5-7-17(8-6-11)15(26)24(16(27)23-17)10-14(25)22-13-4-2-3-12(9-13)18(19,20)21/h2-4,9,11H,5-8,10H2,1H3,(H,22,25)(H,23,27)
InChIKeyLFLHBANRZXNYGM-UHFFFAOYSA-N
MW383.37 g/mol
LogP3.14
Rot. Bonds3

About 2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide

2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide (PubChem CID 4145120) has the molecular formula C18H20F3N3O3 and a molecular weight of 383.37 g/mol. Its IUPAC name is 2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
PubChem CID4145120
Molecular FormulaC18H20F3N3O3
Molecular Weight383.37 g/mol
Exact Mass383.15
IUPAC Name2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
SMILESCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1cccc(C(F)(F)F)c1)C2=O
InChIInChI=1S/C18H20F3N3O3/c1-11-5-7-17(8-6-11)15(26)24(16(27)23-17)10-14(25)22-13-4-2-3-12(9-13)18(19,20)21/h2-4,9,11H,5-8,10H2,1H3,(H,22,25)(H,23,27)
InChIKeyLFLHBANRZXNYGM-UHFFFAOYSA-N
XLogP3.14
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.37
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide 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

Aldumastat
CID 121448788
N-(3-ethylphenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide
CID 4916632
Hydantoin, 3-(alpha,alpha,alpha,4-tetrafluoro-m-tolyl)-
CID 3022015
5,5-Dimethyl-3-(alpha,alpha,alpha,4-tetrafluoro-3-tolyl)hydantoin
CID 129851
Hydantoin, 5,5-dimethyl-3-(alpha,alpha,alpha-trifluoro-m-tolyl)-
CID 3054079
N-[(3,5-difluorophenyl)methyl]-2,2-dimethyl-N-[2-[[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]amino]-2-oxoethyl]propanamide
CID 45485640
N-[(1R)-1-(3,5-difluorophenyl)ethyl]-2,2-dimethyl-N-[2-[[(2S)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]amino]-2-oxoethyl]propanamide
CID 45485687
2-(2,4-dioxo-1,3-diazaspiro[4.5]dec-3-yl)-N-(4-fluorophenyl)acetamide
CID 2078174
2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide
CID 2106714
N-methyl-N-[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]cyclohexanecarboxamide
CID 2519375
2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-(4-propan-2-ylphenyl)acetamide
CID 2708827
Pyrrolidine-1,2-dicarboxylic acid 2-(4-methyl-benzylamide) 1-p-tolylamide
CID 3221243

Frequently Asked Questions

What is the IUPAC name of 2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide (CID 4145120) is 2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide is CC1CCC2(CC1)NC(=O)N(CC(=O)Nc1cccc(C(F)(F)F)c1)C2=O.
What is the InChIKey of 2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide?
The InChIKey is LFLHBANRZXNYGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20F3N3O3/c1-11-5-7-17(8-6-11)15(26)24(16(27)23-17)10-14(25)22-13-4-2-3-12(9-13)18(19,20)21/h2-4,9,11H,5-8,10H2,1H3,(H,22,25)(H,23,27).
What are the key properties of 2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide?
2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide has a molecular weight of 383.37 g/mol, XLogP of 3.14, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[3-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 4145120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).