2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol

C10H10N2O2S — CID 2326298

IUPAC2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol
SMILESCOc1ccc(-c2csc(N)n2)c(O)c1
InChIInChI=1S/C10H10N2O2S/c1-14-6-2-3-7(9(13)4-6)8-5-15-10(11)12-8/h2-5,13H,1H3,(H2,11,12)
InChIKeyCYMNSEWJAXMDRV-UHFFFAOYSA-N
MW222.27 g/mol
LogP2.11
Rot. Bonds2

About 2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol

2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol (PubChem CID 2326298) has the molecular formula C10H10N2O2S and a molecular weight of 222.27 g/mol. Its IUPAC name is 2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol.

Molecular Properties

Compound Name2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol
PubChem CID2326298
Molecular FormulaC10H10N2O2S
Molecular Weight222.27 g/mol
Exact Mass222.05
IUPAC Name2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol
SMILESCOc1ccc(-c2csc(N)n2)c(O)c1
InChIInChI=1S/C10H10N2O2S/c1-14-6-2-3-7(9(13)4-6)8-5-15-10(11)12-8/h2-5,13H,1H3,(H2,11,12)
InChIKeyCYMNSEWJAXMDRV-UHFFFAOYSA-N
XLogP2.11
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.27
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol?
The IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol (CID 2326298) is 2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol.
What is the SMILES notation for 2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol?
The canonical SMILES for 2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol is COc1ccc(-c2csc(N)n2)c(O)c1.
What is the InChIKey of 2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol?
The InChIKey is CYMNSEWJAXMDRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2S/c1-14-6-2-3-7(9(13)4-6)8-5-15-10(11)12-8/h2-5,13H,1H3,(H2,11,12).
What are the key properties of 2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol?
2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol has a molecular weight of 222.27 g/mol, XLogP of 2.11, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1,3-thiazol-4-yl)-5-methoxyphenol is sourced from PubChem (CID 2326298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).