2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol

C11H11NO4S — CID 117192456

IUPAC2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol
SMILESCC1=NC=C(COc2ccccc2O)S1(=O)=O
InChIInChI=1S/C11H11NO4S/c1-8-12-6-9(17(8,14)15)7-16-11-5-3-2-4-10(11)13/h2-6,13H,7H2,1H3
InChIKeyZLSTYUOLFIGZFE-UHFFFAOYSA-N
MW253.28 g/mol
LogP1.46
Rot. Bonds3

About 2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol

2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol (PubChem CID 117192456) has the molecular formula C11H11NO4S and a molecular weight of 253.28 g/mol. Its IUPAC name is 2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol.

Molecular Properties

Compound Name2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol
PubChem CID117192456
Molecular FormulaC11H11NO4S
Molecular Weight253.28 g/mol
Exact Mass253.04
IUPAC Name2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol
SMILESCC1=NC=C(COc2ccccc2O)S1(=O)=O
InChIInChI=1S/C11H11NO4S/c1-8-12-6-9(17(8,14)15)7-16-11-5-3-2-4-10(11)13/h2-6,13H,7H2,1H3
InChIKeyZLSTYUOLFIGZFE-UHFFFAOYSA-N
XLogP1.46
TPSA75.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.28
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2-methyl-1,1-dioxo-1,3-thiazol-4-yl)methoxy]phenol
CID 117191155
2-[(4-fluoro-1,1-dioxo-1-benzothiophen-2-yl)methoxy]phenol
CID 117172586
2-[(6-amino-1,1-dioxo-1-benzothiophen-2-yl)methoxy]phenol
CID 117179578
2-[(2,3-dimethylimidazol-4-yl)methoxy]phenol
CID 117192761
2-[(5-methylfuran-2-yl)methoxy]phenol
CID 43143474
2-[(2-hydroxyphenoxy)methyl]-1,1-dioxo-1,3-thiazole-4-carboxylic acid
CID 117186902
3-[(2-hydroxyphenoxy)methyl]-1,1-dioxo-1-benzothiophen-4-ol
CID 117170648
2-[(5-chloro-1,1-dioxo-1,3-thiazol-2-yl)oxy]phenol
CID 117260259
2-[(4-fluorophenyl)methoxy]phenol
CID 43143460
2-[(2-methyl-3-propan-2-ylimidazol-4-yl)methoxy]phenol
CID 117193031
2-[(4-bromo-2-methylphenyl)methoxy]phenol
CID 117219489
2-[2-[2-(2-hydroxyphenoxy)ethoxy]ethoxy]phenol;methanol
CID 139058411

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol?
The IUPAC name of 2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol (CID 117192456) is 2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol.
What is the SMILES notation for 2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol?
The canonical SMILES for 2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol is CC1=NC=C(COc2ccccc2O)S1(=O)=O.
What is the InChIKey of 2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol?
The InChIKey is ZLSTYUOLFIGZFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO4S/c1-8-12-6-9(17(8,14)15)7-16-11-5-3-2-4-10(11)13/h2-6,13H,7H2,1H3.
What are the key properties of 2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol?
2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol has a molecular weight of 253.28 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methyl-1,1-dioxo-1,3-thiazol-5-yl)methoxy]phenol is sourced from PubChem (CID 117192456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).