(4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride

C11H14ClNO4 — CID 171184283

IUPAC(4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride
SMILESCOc1ccc(OC)c([C@@H]2COC(=O)N2)c1.Cl
InChIInChI=1S/C11H13NO4.ClH/c1-14-7-3-4-10(15-2)8(5-7)9-6-16-11(13)12-9;/h3-5,9H,6H2,1-2H3,(H,12,13);1H/t9-;/m0./s1
InChIKeyZWZBPZUZACVLJY-FVGYRXGTSA-N
MW259.69 g/mol
LogP1.91
Rot. Bonds3

About (4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride

(4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride (PubChem CID 171184283) has the molecular formula C11H14ClNO4 and a molecular weight of 259.69 g/mol. Its IUPAC name is (4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride.

Molecular Properties

Compound Name(4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride
PubChem CID171184283
Molecular FormulaC11H14ClNO4
Molecular Weight259.69 g/mol
Exact Mass259.06
IUPAC Name(4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride
SMILESCOc1ccc(OC)c([C@@H]2COC(=O)N2)c1.Cl
InChIInChI=1S/C11H13NO4.ClH/c1-14-7-3-4-10(15-2)8(5-7)9-6-16-11(13)12-9;/h3-5,9H,6H2,1-2H3,(H,12,13);1H/t9-;/m0./s1
InChIKeyZWZBPZUZACVLJY-FVGYRXGTSA-N
XLogP1.91
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.69
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4R)-4-(2-hydroxy-5-methoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride
CID 171184351
(4R)-4-(2-fluoro-4-methoxyphenyl)-1,3-oxazolidin-2-one
CID 171184318
(4R)-4-(2,5-dimethoxyphenyl)-5,5-dimethyl-1,3-oxazinan-2-one
CID 171186269
2-(2,5-dimethoxyphenyl)azetidine
CID 55295985
(4S)-4-(2-chloro-3,4-dimethoxyphenyl)-1,3-oxazolidin-2-one
CID 171183810
(4S)-4-(2,6-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride
CID 171183799
(4S)-4-(5-bromo-2-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride
CID 171184139
(4S)-4-(2-methoxyphenyl)-1,3-oxazinan-2-one;hydrochloride
CID 171185520
(4R)-4-(3-ethoxy-4-methoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride
CID 171184614
(4S)-4-(4-hydroxy-3-methoxyphenyl)-1,3-oxazolidin-2-one
CID 129373304
5-(2,5-dimethoxyphenyl)-2-methylmorpholine
CID 82291906
(4R)-4-[2-fluoro-5-(trifluoromethoxy)phenyl]-1,3-oxazolidin-2-one;hydrochloride
CID 171184750

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride?
The IUPAC name of (4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride (CID 171184283) is (4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride.
What is the SMILES notation for (4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride?
The canonical SMILES for (4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride is COc1ccc(OC)c([C@@H]2COC(=O)N2)c1.Cl.
What is the InChIKey of (4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride?
The InChIKey is ZWZBPZUZACVLJY-FVGYRXGTSA-N. The full InChI is InChI=1S/C11H13NO4.ClH/c1-14-7-3-4-10(15-2)8(5-7)9-6-16-11(13)12-9;/h3-5,9H,6H2,1-2H3,(H,12,13);1H/t9-;/m0./s1.
What are the key properties of (4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride?
(4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride has a molecular weight of 259.69 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride is sourced from PubChem (CID 171184283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).