2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide

C26H25N3O3 — CID 55398463

IUPAC2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide
SMILESCC(NC(=O)CN1C(=O)NC2(CCc3ccccc3C2)C1=O)c1cccc2ccccc12
InChIInChI=1S/C26H25N3O3/c1-17(21-12-6-10-19-8-4-5-11-22(19)21)27-23(30)16-29-24(31)26(28-25(29)32)14-13-18-7-2-3-9-20(18)15-26/h2-12,17H,13-16H2,1H3,(H,27,30)(H,28,32)
InChIKeyZNHIWQMPDWRVQR-UHFFFAOYSA-N
MW427.50 g/mol
LogP3.50
Rot. Bonds4

About 2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide

2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide (PubChem CID 55398463) has the molecular formula C26H25N3O3 and a molecular weight of 427.50 g/mol. Its IUPAC name is 2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide.

Molecular Properties

Compound Name2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide
PubChem CID55398463
Molecular FormulaC26H25N3O3
Molecular Weight427.50 g/mol
Exact Mass427.19
IUPAC Name2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide
SMILESCC(NC(=O)CN1C(=O)NC2(CCc3ccccc3C2)C1=O)c1cccc2ccccc12
InChIInChI=1S/C26H25N3O3/c1-17(21-12-6-10-19-8-4-5-11-22(19)21)27-23(30)16-29-24(31)26(28-25(29)32)14-13-18-7-2-3-9-20(18)15-26/h2-12,17H,13-16H2,1H3,(H,27,30)(H,28,32)
InChIKeyZNHIWQMPDWRVQR-UHFFFAOYSA-N
XLogP3.50
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.50
LogP ≤ 53.50
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'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 55366827
2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-thiophen-2-ylethyl)acetamide
CID 84601357
2-[(3R)-2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl]-N-naphthalen-1-ylacetamide
CID 2364607
2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-propylacetamide
CID 84601373
N-(2,6-dichlorophenyl)-2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)acetamide
CID 112774177
2-[[2-[(3S)-2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl]acetyl]amino]-N-[(1S)-1-phenylethyl]benzamide
CID 2454039
2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-prop-2-enylacetamide
CID 84601367
N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)acetamide
CID 55398348
2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(4-fluorophenyl)acetamide
CID 3662145
2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)-N-[1-(2-methylphenyl)ethyl]acetamide
CID 18097547
2-[(4S)-4-[(2-methoxyphenyl)methyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide
CID 40855215
2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(3,3-diphenylpropyl)acetamide
CID 55304583

Frequently Asked Questions

What is the IUPAC name of 2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide?
The IUPAC name of 2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide (CID 55398463) is 2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide.
What is the SMILES notation for 2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide?
The canonical SMILES for 2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide is CC(NC(=O)CN1C(=O)NC2(CCc3ccccc3C2)C1=O)c1cccc2ccccc12.
What is the InChIKey of 2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide?
The InChIKey is ZNHIWQMPDWRVQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N3O3/c1-17(21-12-6-10-19-8-4-5-11-22(19)21)27-23(30)16-29-24(31)26(28-25(29)32)14-13-18-7-2-3-9-20(18)15-26/h2-12,17H,13-16H2,1H3,(H,27,30)(H,28,32).
What are the key properties of 2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide?
2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide has a molecular weight of 427.50 g/mol, XLogP of 3.50, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2',5'-dioxospiro[2,4-dihydro-1H-naphthalene-3,4'-imidazolidine]-1'-yl)-N-(1-naphthalen-1-ylethyl)acetamide is sourced from PubChem (CID 55398463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).