spiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione

C10H7N3O3 — CID 15554858

IUPACspiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione
SMILESO=C1NC(=O)C2(N1)C(=O)Nc1ccccc12
InChIInChI=1S/C10H7N3O3/c14-7-10(8(15)12-9(16)13-10)5-3-1-2-4-6(5)11-7/h1-4H,(H,11,14)(H2,12,13,15,16)
InChIKeyVCZILNWKBJBQGN-UHFFFAOYSA-N
MW217.18 g/mol
LogP-0.33
Rot. Bonds

About spiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione

spiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione (PubChem CID 15554858) has the molecular formula C10H7N3O3 and a molecular weight of 217.18 g/mol. Its IUPAC name is spiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione.

Molecular Properties

Compound Namespiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione
PubChem CID15554858
Molecular FormulaC10H7N3O3
Molecular Weight217.18 g/mol
Exact Mass217.05
IUPAC Namespiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione
SMILESO=C1NC(=O)C2(N1)C(=O)Nc1ccccc12
InChIInChI=1S/C10H7N3O3/c14-7-10(8(15)12-9(16)13-10)5-3-1-2-4-6(5)11-7/h1-4H,(H,11,14)(H2,12,13,15,16)
InChIKeyVCZILNWKBJBQGN-UHFFFAOYSA-N
XLogP-0.33
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.18
LogP ≤ 5-0.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

sodium;5,5-diphenylimidazolidine-2,4-dione;hydride
CID 154804358
3,3-dichloro-1H-indol-2-one
CID 719018
1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione
CID 70574558
4-methylspiro[fluorene-9,5'-imidazolidine]-2',4'-dione
CID 158182679
3,3-dimethyl-1H-indol-2-one;ethanol
CID 158151574
spiro[1H-indole-3,1'-cyclopropane]-2-one;hydrochloride
CID 141126988
CID 146949857
CID 146949857
2,4-difluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione
CID 138496482
3-ethyl-3-propan-2-yl-1H-indol-2-one
CID 45094674
(3S)-3-methyl-3-phenyl-1H-indol-2-one
CID 102419408
(3R)-3-hydroxy-3-(2-hydroxyphenyl)-1H-indol-2-one
CID 7102076
3,3-dimethoxy-1H-indol-2-one;ethane
CID 54484011

Frequently Asked Questions

What is the IUPAC name of spiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione?
The IUPAC name of spiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione (CID 15554858) is spiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione.
What is the SMILES notation for spiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione?
The canonical SMILES for spiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione is O=C1NC(=O)C2(N1)C(=O)Nc1ccccc12.
What is the InChIKey of spiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione?
The InChIKey is VCZILNWKBJBQGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3O3/c14-7-10(8(15)12-9(16)13-10)5-3-1-2-4-6(5)11-7/h1-4H,(H,11,14)(H2,12,13,15,16).
What are the key properties of spiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione?
spiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione has a molecular weight of 217.18 g/mol, XLogP of -0.33, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1H-indole-3,5'-imidazolidine]-2,2',4'-trione is sourced from PubChem (CID 15554858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).