3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione

C18H16N2O4 — CID 84572007

IUPAC3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione
SMILESCOc1cccc(C(=O)CN2C(=O)NC(c3ccccc3)C2=O)c1
InChIInChI=1S/C18H16N2O4/c1-24-14-9-5-8-13(10-14)15(21)11-20-17(22)16(19-18(20)23)12-6-3-2-4-7-12/h2-10,16H,11H2,1H3,(H,19,23)
InChIKeyMXQHZZPYEONJLL-UHFFFAOYSA-N
MW324.34 g/mol
LogP2.17
Rot. Bonds5

About 3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione

3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione (PubChem CID 84572007) has the molecular formula C18H16N2O4 and a molecular weight of 324.34 g/mol. Its IUPAC name is 3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione
PubChem CID84572007
Molecular FormulaC18H16N2O4
Molecular Weight324.34 g/mol
Exact Mass324.11
IUPAC Name3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione
SMILESCOc1cccc(C(=O)CN2C(=O)NC(c3ccccc3)C2=O)c1
InChIInChI=1S/C18H16N2O4/c1-24-14-9-5-8-13(10-14)15(21)11-20-17(22)16(19-18(20)23)12-6-3-2-4-7-12/h2-10,16H,11H2,1H3,(H,19,23)
InChIKeyMXQHZZPYEONJLL-UHFFFAOYSA-N
XLogP2.17
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[2-(3-methoxyphenyl)-2-oxoethyl]-3-azabicyclo[3.1.0]hexane-2,4-dione
CID 64835683
2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 84571944
(5S,6R)-3-[2-(3-methoxyphenyl)-2-oxoethyl]-6-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 40791004
5-(4-fluorophenyl)-3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-methylimidazolidine-2,4-dione
CID 17477743
4-[2-(3-methoxyphenyl)-2-oxoethyl]piperazine-1-carbaldehyde
CID 82121920
2-(4-aminopiperidin-1-yl)-1-(3-methoxyphenyl)ethanone
CID 56828695
2-(3-aminoazetidin-1-yl)-1-(3-methoxyphenyl)ethanone
CID 121200257
2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetohydrazide
CID 84571871
3-ethyl-5-phenylimidazolidine-2,4-dione
CID 3292
(2R)-2-ethyl-4-[2-(3-methoxyphenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5-dione
CID 40640305
2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone
CID 43219308
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-(3-methoxyphenyl)ethanone
CID 93026009

Frequently Asked Questions

What is the IUPAC name of 3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione?
The IUPAC name of 3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione (CID 84572007) is 3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione?
The canonical SMILES for 3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione is COc1cccc(C(=O)CN2C(=O)NC(c3ccccc3)C2=O)c1.
What is the InChIKey of 3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione?
The InChIKey is MXQHZZPYEONJLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O4/c1-24-14-9-5-8-13(10-14)15(21)11-20-17(22)16(19-18(20)23)12-6-3-2-4-7-12/h2-10,16H,11H2,1H3,(H,19,23).
What are the key properties of 3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione?
3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione has a molecular weight of 324.34 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3-methoxyphenyl)-2-oxoethyl]-5-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 84572007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).