(4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one

C10H11NO4 — CID 129373304

IUPAC(4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one
SMILESCOc1cc([C@H]2COC(=O)N2)ccc1O
InChIInChI=1S/C10H11NO4/c1-14-9-4-6(2-3-8(9)12)7-5-15-10(13)11-7/h2-4,7,12H,5H2,1H3,(H,11,13)/t7-/m1/s1
InChIKeyWGPOMNROGVAUGK-SSDOTTSWSA-N
MW209.20 g/mol
LogP1.18
Rot. Bonds2

About (4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one

(4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one (PubChem CID 129373304) has the molecular formula C10H11NO4 and a molecular weight of 209.20 g/mol. Its IUPAC name is (4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one
PubChem CID129373304
Molecular FormulaC10H11NO4
Molecular Weight209.20 g/mol
Exact Mass209.07
IUPAC Name(4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one
SMILESCOc1cc([C@H]2COC(=O)N2)ccc1O
InChIInChI=1S/C10H11NO4/c1-14-9-4-6(2-3-8(9)12)7-5-15-10(13)11-7/h2-4,7,12H,5H2,1H3,(H,11,13)/t7-/m1/s1
InChIKeyWGPOMNROGVAUGK-SSDOTTSWSA-N
XLogP1.18
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one with MolForge

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Related Compounds

(4R)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazinan-2-one;hydrochloride
CID 171184949
(4S)-4-(3-ethoxy-4-hydroxyphenyl)-1,3-oxazolidin-2-one
CID 130067438
4-(3,4-dihydroxyphenyl)-1,3-oxazolidin-2-one
CID 130144619
(4R)-4-(3-ethoxy-4-methoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride
CID 171184614
(4S)-4-(5-bromo-2-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride
CID 171184139
(4R)-4-(2-hydroxy-5-methoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride
CID 171184351
2,5-bis(4-hydroxy-3-methoxyphenyl)cyclopentan-1-one
CID 100938571
4-(6-methoxy-3-pyridinyl)-1,3-oxazolidin-2-one
CID 114938799
(5R)-5-(4-hydroxy-3-methoxyphenyl)imidazolidine-2,4-dione
CID 699519
(4R)-4-(3-methoxy-4-methylphenyl)-1,3-oxazinan-2-one;hydrochloride
CID 171185050
(4S)-4-(2,6-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride
CID 171183799
(4R)-4-(3-bromo-4-methylphenyl)-1,3-oxazolidin-2-one
CID 171184420

Frequently Asked Questions

What is the IUPAC name of (4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one?
The IUPAC name of (4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one (CID 129373304) is (4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for (4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one?
The canonical SMILES for (4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one is COc1cc([C@H]2COC(=O)N2)ccc1O.
What is the InChIKey of (4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one?
The InChIKey is WGPOMNROGVAUGK-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H11NO4/c1-14-9-4-6(2-3-8(9)12)7-5-15-10(13)11-7/h2-4,7,12H,5H2,1H3,(H,11,13)/t7-/m1/s1.
What are the key properties of (4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one?
(4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one has a molecular weight of 209.20 g/mol, XLogP of 1.18, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 129373304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).