4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol

C11H11NO2S — CID 105477646

IUPAC4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol
SMILESCc1sc(CO)nc1-c1ccc(O)cc1
InChIInChI=1S/C11H11NO2S/c1-7-11(12-10(6-13)15-7)8-2-4-9(14)5-3-8/h2-5,13-14H,6H2,1H3
InChIKeyLPUIVTYLLNVCLK-UHFFFAOYSA-N
MW221.28 g/mol
LogP2.32
Rot. Bonds2

About 4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol

4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol (PubChem CID 105477646) has the molecular formula C11H11NO2S and a molecular weight of 221.28 g/mol. Its IUPAC name is 4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol.

Molecular Properties

Compound Name4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol
PubChem CID105477646
Molecular FormulaC11H11NO2S
Molecular Weight221.28 g/mol
Exact Mass221.05
IUPAC Name4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol
SMILESCc1sc(CO)nc1-c1ccc(O)cc1
InChIInChI=1S/C11H11NO2S/c1-7-11(12-10(6-13)15-7)8-2-4-9(14)5-3-8/h2-5,13-14H,6H2,1H3
InChIKeyLPUIVTYLLNVCLK-UHFFFAOYSA-N
XLogP2.32
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.28
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[5-methyl-4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]methanol
CID 116867390
[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]methanol
CID 116867366
O-[[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]methyl]hydroxylamine
CID 82044166
[4-(3-chloro-4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]methanol
CID 116867349
2-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]ethanol
CID 39351949
5-methyl-2-[2-(5-methyl-4-phenyl-1,3-thiazol-2-yl)ethyl]-4-phenyl-1,3-thiazole
CID 2129747
4-[2-(hydroxymethyl)-5-methyl-1H-imidazol-4-yl]phenol
CID 105456043
4-[[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]amino]phenol
CID 93206365
2-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]acetamide
CID 9174038
2-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]ethanethioamide
CID 116868765
N-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]methyl]ethanamine
CID 62543522
[5-methyl-4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]methanamine
CID 39349446

Frequently Asked Questions

What is the IUPAC name of 4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol?
The IUPAC name of 4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol (CID 105477646) is 4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol.
What is the SMILES notation for 4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol?
The canonical SMILES for 4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol is Cc1sc(CO)nc1-c1ccc(O)cc1.
What is the InChIKey of 4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol?
The InChIKey is LPUIVTYLLNVCLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2S/c1-7-11(12-10(6-13)15-7)8-2-4-9(14)5-3-8/h2-5,13-14H,6H2,1H3.
What are the key properties of 4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol?
4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol has a molecular weight of 221.28 g/mol, XLogP of 2.32, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(hydroxymethyl)-5-methyl-1,3-thiazol-4-yl]phenol is sourced from PubChem (CID 105477646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).