5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one

C12H15NO5 — CID 21423647

IUPAC5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one
SMILESCOc1cccc(OC)c1OCC1CNC(=O)O1
InChIInChI=1S/C12H15NO5/c1-15-9-4-3-5-10(16-2)11(9)17-7-8-6-13-12(14)18-8/h3-5,8H,6-7H2,1-2H3,(H,13,14)
InChIKeyTWWPOSGEDWDEPU-UHFFFAOYSA-N
MW253.25 g/mol
LogP1.19
Rot. Bonds5

About 5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one

5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one (PubChem CID 21423647) has the molecular formula C12H15NO5 and a molecular weight of 253.25 g/mol. Its IUPAC name is 5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one
PubChem CID21423647
Molecular FormulaC12H15NO5
Molecular Weight253.25 g/mol
Exact Mass253.10
IUPAC Name5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one
SMILESCOc1cccc(OC)c1OCC1CNC(=O)O1
InChIInChI=1S/C12H15NO5/c1-15-9-4-3-5-10(16-2)11(9)17-7-8-6-13-12(14)18-8/h3-5,8H,6-7H2,1-2H3,(H,13,14)
InChIKeyTWWPOSGEDWDEPU-UHFFFAOYSA-N
XLogP1.19
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.25
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

CID 66849130
CID 66849130
(5R)-5-(naphthalen-1-yloxymethyl)-1,3-oxazolidin-2-one
CID 754370
methanesulfonic acid;5-[(2-methoxyphenoxy)methyl]-1,3-oxazolidin-2-one
CID 87722700
(5S)-5-[(2-butoxyphenoxy)methyl]-1,3-oxazolidin-2-one
CID 95561590
5-[(2-methoxyphenoxy)methyl]-1,3-oxazolidin-2-one;prop-2-enoic acid
CID 66663546
(5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one
CID 950474
3-methyl-2-[(2-oxo-1,3-oxazolidin-5-yl)methoxy]benzoic acid
CID 54929992
5-[(5-chloro-2-methoxyphenoxy)methyl]-1,3-oxazolidin-2-one
CID 21496492
(5R)-5-[[7-(3,4,5-trimethoxyphenyl)quinolin-5-yl]oxymethyl]-1,3-oxazolidin-2-one
CID 71241898
1,2-benzoxazole;5-[(2-methoxyphenoxy)methyl]-1,3-oxazolidin-2-one
CID 68913573
5-[[2-(aminomethyl)-4-chloro-6-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one
CID 104664108
3-chloro-2-[(2-oxo-1,3-oxazolidin-5-yl)methoxy]benzoic acid
CID 112612064

Frequently Asked Questions

What is the IUPAC name of 5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one?
The IUPAC name of 5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one (CID 21423647) is 5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one is COc1cccc(OC)c1OCC1CNC(=O)O1.
What is the InChIKey of 5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one?
The InChIKey is TWWPOSGEDWDEPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO5/c1-15-9-4-3-5-10(16-2)11(9)17-7-8-6-13-12(14)18-8/h3-5,8H,6-7H2,1-2H3,(H,13,14).
What are the key properties of 5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one?
5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one has a molecular weight of 253.25 g/mol, XLogP of 1.19, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 21423647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).