1-ethyl-3-(2-phenoxyethyl)imidazol-2-one

C13H16N2O2 — CID 116624118

IUPAC1-ethyl-3-(2-phenoxyethyl)imidazol-2-one
SMILESCCn1ccn(CCOc2ccccc2)c1=O
InChIInChI=1S/C13H16N2O2/c1-2-14-8-9-15(13(14)16)10-11-17-12-6-4-3-5-7-12/h3-9H,2,10-11H2,1H3
InChIKeyIPVFJXKYFQGUPF-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.75
Rot. Bonds5

About 1-ethyl-3-(2-phenoxyethyl)imidazol-2-one

1-ethyl-3-(2-phenoxyethyl)imidazol-2-one (PubChem CID 116624118) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 1-ethyl-3-(2-phenoxyethyl)imidazol-2-one.

Molecular Properties

Compound Name1-ethyl-3-(2-phenoxyethyl)imidazol-2-one
PubChem CID116624118
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name1-ethyl-3-(2-phenoxyethyl)imidazol-2-one
SMILESCCn1ccn(CCOc2ccccc2)c1=O
InChIInChI=1S/C13H16N2O2/c1-2-14-8-9-15(13(14)16)10-11-17-12-6-4-3-5-7-12/h3-9H,2,10-11H2,1H3
InChIKeyIPVFJXKYFQGUPF-UHFFFAOYSA-N
XLogP1.75
TPSA36.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-ethyl-3-(2-phenoxyethyl)imidazol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(2-methoxyphenoxy)ethyl]-3-propylimidazol-2-one
CID 116624789
2-[4-[2-(2-oxo-3-propylimidazol-1-yl)ethoxy]phenyl]acetonitrile
CID 80579298
1-[1-(2-phenoxyethyl)pyrrol-2-yl]ethanone
CID 79107007
ethyl 1-(2-phenoxyethyl)pyrrole-2-carboxylate
CID 105421875
1-ethyl-3-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazol-2-one
CID 116624225
1-(2-phenoxyethyl)piperidin-4-one
CID 70278679
1-(1-ethylimidazol-2-yl)-4-phenoxybutan-2-one
CID 79744818
3-benzyl-5-methyl-1-(2-phenoxyethyl)pyrimidine-2,4-dione
CID 5302093
1-[3-[3-(aminomethyl)phenoxy]propyl]-3-propylimidazol-2-one
CID 80579823
N-[(1-ethylpyrrol-2-yl)methyl]-3-phenoxypropan-1-amine
CID 66444605
1-[2-(2-aminophenoxy)ethyl]-3-methylimidazol-2-one
CID 80579090
2-[2-(2-oxo-3-propylimidazol-1-yl)ethoxy]benzenecarbothioamide
CID 80579353

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(2-phenoxyethyl)imidazol-2-one?
The IUPAC name of 1-ethyl-3-(2-phenoxyethyl)imidazol-2-one (CID 116624118) is 1-ethyl-3-(2-phenoxyethyl)imidazol-2-one.
What is the SMILES notation for 1-ethyl-3-(2-phenoxyethyl)imidazol-2-one?
The canonical SMILES for 1-ethyl-3-(2-phenoxyethyl)imidazol-2-one is CCn1ccn(CCOc2ccccc2)c1=O.
What is the InChIKey of 1-ethyl-3-(2-phenoxyethyl)imidazol-2-one?
The InChIKey is IPVFJXKYFQGUPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-2-14-8-9-15(13(14)16)10-11-17-12-6-4-3-5-7-12/h3-9H,2,10-11H2,1H3.
What are the key properties of 1-ethyl-3-(2-phenoxyethyl)imidazol-2-one?
1-ethyl-3-(2-phenoxyethyl)imidazol-2-one has a molecular weight of 232.28 g/mol, XLogP of 1.75, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(2-phenoxyethyl)imidazol-2-one is sourced from PubChem (CID 116624118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).