1-cyclopropyl-3-phenacylimidazolidine-2,4-dione

C14H14N2O3 — CID 87022456

IUPAC1-cyclopropyl-3-phenacylimidazolidine-2,4-dione
SMILESO=C(CN1C(=O)CN(C2CC2)C1=O)c1ccccc1
InChIInChI=1S/C14H14N2O3/c17-12(10-4-2-1-3-5-10)8-16-13(18)9-15(14(16)19)11-6-7-11/h1-5,11H,6-9H2
InChIKeyRWOIYMGEUYAIRW-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.30
Rot. Bonds4

About 1-cyclopropyl-3-phenacylimidazolidine-2,4-dione

1-cyclopropyl-3-phenacylimidazolidine-2,4-dione (PubChem CID 87022456) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is 1-cyclopropyl-3-phenacylimidazolidine-2,4-dione.

Molecular Properties

Compound Name1-cyclopropyl-3-phenacylimidazolidine-2,4-dione
PubChem CID87022456
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC Name1-cyclopropyl-3-phenacylimidazolidine-2,4-dione
SMILESO=C(CN1C(=O)CN(C2CC2)C1=O)c1ccccc1
InChIInChI=1S/C14H14N2O3/c17-12(10-4-2-1-3-5-10)8-16-13(18)9-15(14(16)19)11-6-7-11/h1-5,11H,6-9H2
InChIKeyRWOIYMGEUYAIRW-UHFFFAOYSA-N
XLogP1.30
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(1-phenacylpiperidin-4-yl)-3-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione
CID 126854984
3-benzyl-1-cyclopropylimidazolidine-2,4-dione
CID 87022344
3-[(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)methyl]benzoic acid
CID 167942155
N-(2-chlorophenyl)-2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 87022378
2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide
CID 87022436
1-phenacylpyrrolidine-2,5-dione
CID 717114
2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N,N-dimethylacetamide
CID 87022480
N-cyclopropyl-2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 87022402
2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide
CID 87022608
3-[2-(azepan-1-yl)-2-oxoethyl]-1-cyclopropylimidazolidine-2,4-dione
CID 87022365
1-cyclohexyl-3-phenacylimidazolidine-2,4,5-trione
CID 34603406
1-cyclopropyl-3-[2-[2,5-dimethyl-1-(3-methylphenyl)pyrrol-3-yl]-2-oxoethyl]imidazolidine-2,4-dione
CID 87022827

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-phenacylimidazolidine-2,4-dione?
The IUPAC name of 1-cyclopropyl-3-phenacylimidazolidine-2,4-dione (CID 87022456) is 1-cyclopropyl-3-phenacylimidazolidine-2,4-dione.
What is the SMILES notation for 1-cyclopropyl-3-phenacylimidazolidine-2,4-dione?
The canonical SMILES for 1-cyclopropyl-3-phenacylimidazolidine-2,4-dione is O=C(CN1C(=O)CN(C2CC2)C1=O)c1ccccc1.
What is the InChIKey of 1-cyclopropyl-3-phenacylimidazolidine-2,4-dione?
The InChIKey is RWOIYMGEUYAIRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c17-12(10-4-2-1-3-5-10)8-16-13(18)9-15(14(16)19)11-6-7-11/h1-5,11H,6-9H2.
What are the key properties of 1-cyclopropyl-3-phenacylimidazolidine-2,4-dione?
1-cyclopropyl-3-phenacylimidazolidine-2,4-dione has a molecular weight of 258.28 g/mol, XLogP of 1.30, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-phenacylimidazolidine-2,4-dione is sourced from PubChem (CID 87022456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).