2-(1,3-thiazol-2-yl)ethanol;hydrochloride

C5H8ClNOS — CID 173116939

IUPAC2-(1,3-thiazol-2-yl)ethanol;hydrochloride
SMILESCl.OCCc1nccs1
InChIInChI=1S/C5H7NOS.ClH/c7-3-1-5-6-2-4-8-5;/h2,4,7H,1,3H2;1H
InChIKeyJSSSMEQYWYQDIC-UHFFFAOYSA-N
MW165.65 g/mol
LogP1.10
Rot. Bonds2

About 2-(1,3-thiazol-2-yl)ethanol;hydrochloride

2-(1,3-thiazol-2-yl)ethanol;hydrochloride (PubChem CID 173116939) has the molecular formula C5H8ClNOS and a molecular weight of 165.65 g/mol. Its IUPAC name is 2-(1,3-thiazol-2-yl)ethanol;hydrochloride.

Molecular Properties

Compound Name2-(1,3-thiazol-2-yl)ethanol;hydrochloride
PubChem CID173116939
Molecular FormulaC5H8ClNOS
Molecular Weight165.65 g/mol
Exact Mass165.00
IUPAC Name2-(1,3-thiazol-2-yl)ethanol;hydrochloride
SMILESCl.OCCc1nccs1
InChIInChI=1S/C5H7NOS.ClH/c7-3-1-5-6-2-4-8-5;/h2,4,7H,1,3H2;1H
InChIKeyJSSSMEQYWYQDIC-UHFFFAOYSA-N
XLogP1.10
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.65
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(chloromethyl)-1,3-thiazole;hydrochloride
CID 23043559
3-(1,3-thiazol-2-yl)propanamide
CID 45121787
2-(2-methylpropyl)-1,3-thiazole;2-(4-methyl-1,3-thiazol-5-yl)ethanol
CID 122696460
2-but-3-ynyl-1,3-thiazole
CID 87801574
N-iodo-2-(1,3-thiazol-2-yl)ethanamine
CID 137452216
3-(1,3-thiazol-2-yl)propanal;hydrobromide
CID 87751457
2-(2-methoxyethyl)-1,3-thiazole
CID 59275905
4-[2-(1,3-thiazol-2-yl)ethylamino]pentan-1-ol
CID 115971769
5-(1,3-thiazol-2-yl)pentan-2-ol
CID 79824086
1-(1,3-thiazol-2-yl)pentan-3-one
CID 58326627
6-(1,3-thiazol-2-yl)hexan-2-one
CID 134309859
5-(1,3-thiazol-2-ylmethylamino)pentan-1-ol
CID 107302916

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-thiazol-2-yl)ethanol;hydrochloride?
The IUPAC name of 2-(1,3-thiazol-2-yl)ethanol;hydrochloride (CID 173116939) is 2-(1,3-thiazol-2-yl)ethanol;hydrochloride.
What is the SMILES notation for 2-(1,3-thiazol-2-yl)ethanol;hydrochloride?
The canonical SMILES for 2-(1,3-thiazol-2-yl)ethanol;hydrochloride is Cl.OCCc1nccs1.
What is the InChIKey of 2-(1,3-thiazol-2-yl)ethanol;hydrochloride?
The InChIKey is JSSSMEQYWYQDIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NOS.ClH/c7-3-1-5-6-2-4-8-5;/h2,4,7H,1,3H2;1H.
What are the key properties of 2-(1,3-thiazol-2-yl)ethanol;hydrochloride?
2-(1,3-thiazol-2-yl)ethanol;hydrochloride has a molecular weight of 165.65 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-thiazol-2-yl)ethanol;hydrochloride is sourced from PubChem (CID 173116939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).