1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one

C11H11BrN2O3 — CID 9466285

IUPAC1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one
SMILESO=C(COc1ccccc1Br)N1CCNC1=O
InChIInChI=1S/C11H11BrN2O3/c12-8-3-1-2-4-9(8)17-7-10(15)14-6-5-13-11(14)16/h1-4H,5-7H2,(H,13,16)
InChIKeyBQMRMHIVNMYLNW-UHFFFAOYSA-N
MW299.12 g/mol
LogP1.38
Rot. Bonds3

About 1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one

1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one (PubChem CID 9466285) has the molecular formula C11H11BrN2O3 and a molecular weight of 299.12 g/mol. Its IUPAC name is 1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one
PubChem CID9466285
Molecular FormulaC11H11BrN2O3
Molecular Weight299.12 g/mol
Exact Mass298.00
IUPAC Name1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one
SMILESO=C(COc1ccccc1Br)N1CCNC1=O
InChIInChI=1S/C11H11BrN2O3/c12-8-3-1-2-4-9(8)17-7-10(15)14-6-5-13-11(14)16/h1-4H,5-7H2,(H,13,16)
InChIKeyBQMRMHIVNMYLNW-UHFFFAOYSA-N
XLogP1.38
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.12
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(2-chlorophenoxy)acetate
CID 8908985
[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-ethoxybenzoate
CID 7758181
2-(2-bromophenoxy)-1-morpholin-4-ylethanone
CID 725441
1-[2-(4-aminophenoxy)acetyl]imidazolidin-2-one
CID 54909200
[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-phenylacetate
CID 7874639
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide
CID 166219619
1-[2-(3,5-dichlorophenoxy)acetyl]imidazolidin-2-one
CID 7467120
1-[2-[3-(aminomethyl)phenoxy]acetyl]imidazolidin-2-one
CID 106485198
1-O-methyl 2-O-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] benzene-1,2-dicarboxylate
CID 56505352
1-(3-bromopyridine-2-carbonyl)imidazolidin-2-one
CID 107518186
[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(2,6-dimethylphenoxy)acetate
CID 8527890
[(2S)-1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl] 2-(2-bromo-4-fluorophenoxy)acetate
CID 8737791

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one?
The IUPAC name of 1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one (CID 9466285) is 1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one is O=C(COc1ccccc1Br)N1CCNC1=O.
What is the InChIKey of 1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one?
The InChIKey is BQMRMHIVNMYLNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2O3/c12-8-3-1-2-4-9(8)17-7-10(15)14-6-5-13-11(14)16/h1-4H,5-7H2,(H,13,16).
What are the key properties of 1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one?
1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one has a molecular weight of 299.12 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one is sourced from PubChem (CID 9466285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).