4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one

C13H16N2O3 — CID 116980510

IUPAC4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one
SMILESCOc1cccc(C2CN(CC(C)=O)C(=O)N2)c1
InChIInChI=1S/C13H16N2O3/c1-9(16)7-15-8-12(14-13(15)17)10-4-3-5-11(6-10)18-2/h3-6,12H,7-8H2,1-2H3,(H,14,17)
InChIKeyCFKCLBUFTZUHBQ-UHFFFAOYSA-N
MW248.28 g/mol
LogP1.35
Rot. Bonds4

About 4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one

4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one (PubChem CID 116980510) has the molecular formula C13H16N2O3 and a molecular weight of 248.28 g/mol. Its IUPAC name is 4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one.

Molecular Properties

Compound Name4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one
PubChem CID116980510
Molecular FormulaC13H16N2O3
Molecular Weight248.28 g/mol
Exact Mass248.12
IUPAC Name4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one
SMILESCOc1cccc(C2CN(CC(C)=O)C(=O)N2)c1
InChIInChI=1S/C13H16N2O3/c1-9(16)7-15-8-12(14-13(15)17)10-4-3-5-11(6-10)18-2/h3-6,12H,7-8H2,1-2H3,(H,14,17)
InChIKeyCFKCLBUFTZUHBQ-UHFFFAOYSA-N
XLogP1.35
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-aminopropyl)-4-(3-methoxyphenyl)imidazolidin-2-one
CID 116978424
4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one
CID 116978630
4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one
CID 116980486
4-(3-methoxyphenyl)-1-pyrrolidin-3-ylimidazolidin-2-one
CID 116978989
ethane;1-[3-(3-methoxyphenyl)piperazin-1-yl]ethanone
CID 142506558
7-(3-methoxyphenyl)azepan-2-one
CID 12665502
3-(3-methoxyphenyl)-5-oxo-8,11-dioxa-1,4-diazaspiro[5.6]dodecane-1-carboxylate
CID 86668538
6-(3-methoxyphenyl)piperidine-2,4-dione
CID 83822055
2-[4-(3-methoxyphenyl)piperidin-1-yl]acetic acid
CID 18184335
(4R)-1-cyclopropyl-4-[(2S)-2-(3-methoxyphenyl)pyrrolidine-1-carbonyl]pyrrolidin-2-one
CID 95567810
4-acetyl-3-(3-methoxyphenyl)-2,3,7,8-tetrahydropyrido[1,2-c]pyrimidin-1-one
CID 73440828
bis[2-(3-methoxyphenyl)pyrrolidin-1-yl]methanone
CID 174863821

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one?
The IUPAC name of 4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one (CID 116980510) is 4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one.
What is the SMILES notation for 4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one?
The canonical SMILES for 4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one is COc1cccc(C2CN(CC(C)=O)C(=O)N2)c1.
What is the InChIKey of 4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one?
The InChIKey is CFKCLBUFTZUHBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O3/c1-9(16)7-15-8-12(14-13(15)17)10-4-3-5-11(6-10)18-2/h3-6,12H,7-8H2,1-2H3,(H,14,17).
What are the key properties of 4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one?
4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one has a molecular weight of 248.28 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one is sourced from PubChem (CID 116980510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).