(4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one

C11H14N2O3 — CID 131349347

IUPAC(4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one
SMILESCCOc1cc([C@H]2CNC(=O)N2)ccc1O
InChIInChI=1S/C11H14N2O3/c1-2-16-10-5-7(3-4-9(10)14)8-6-12-11(15)13-8/h3-5,8,14H,2,6H2,1H3,(H2,12,13,15)/t8-/m1/s1
InChIKeyGLEMMJFCEUJUEU-MRVPVSSYSA-N
MW222.24 g/mol
LogP1.14
Rot. Bonds3

About (4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one

(4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one (PubChem CID 131349347) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is (4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one.

Molecular Properties

Compound Name(4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one
PubChem CID131349347
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC Name(4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one
SMILESCCOc1cc([C@H]2CNC(=O)N2)ccc1O
InChIInChI=1S/C11H14N2O3/c1-2-16-10-5-7(3-4-9(10)14)8-6-12-11(15)13-8/h3-5,8,14H,2,6H2,1H3,(H2,12,13,15)/t8-/m1/s1
InChIKeyGLEMMJFCEUJUEU-MRVPVSSYSA-N
XLogP1.14
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2R)-azetidin-2-yl]-2-ethoxyphenol
CID 131080980
(4S)-4-(3-ethoxy-4-hydroxyphenyl)-1,3-oxazolidin-2-one
CID 130067438
[2-methoxy-4-[(4R)-2-oxoimidazolidin-4-yl]phenyl] acetate
CID 171252600
4-(3-ethoxy-4-hydroxyphenyl)-1,3,4,6,7,8-hexahydroquinazoline-2,5-dione
CID 23968011
4-(3,4-diethoxyphenyl)azetidin-2-one
CID 131885056
(4R)-4-(3-ethoxy-4-hydroxyphenyl)-5,5-difluoro-1,3-oxazinan-2-one
CID 171187777
(4R)-4-(3-hydroxyphenyl)imidazolidin-2-one
CID 131198796
propyl 4-(3-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
CID 3131461
3-(3-ethoxy-4-hydroxyphenyl)-3,5,6,7,8,8a-hexahydro-2H-imidazo[1,5-a]pyridin-1-one
CID 60525794
cycloheptyl (4R)-4-(3-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
CID 1238586
ethyl (4S)-4-(3-ethoxy-4-hydroxyphenyl)-2-oxo-6-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate
CID 2370299
2,2,2-trifluoroethyl (4R)-4-(3-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
CID 1042375

Frequently Asked Questions

What is the IUPAC name of (4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one?
The IUPAC name of (4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one (CID 131349347) is (4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one.
What is the SMILES notation for (4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one?
The canonical SMILES for (4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one is CCOc1cc([C@H]2CNC(=O)N2)ccc1O.
What is the InChIKey of (4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one?
The InChIKey is GLEMMJFCEUJUEU-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-2-16-10-5-7(3-4-9(10)14)8-6-12-11(15)13-8/h3-5,8,14H,2,6H2,1H3,(H2,12,13,15)/t8-/m1/s1.
What are the key properties of (4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one?
(4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one has a molecular weight of 222.24 g/mol, XLogP of 1.14, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-(3-ethoxy-4-hydroxyphenyl)imidazolidin-2-one is sourced from PubChem (CID 131349347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).