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

C5H7NOS — CID 20550112

IUPAC2-(1,2-thiazol-3-yl)ethanol
SMILESOCCc1ccsn1
InChIInChI=1S/C5H7NOS/c7-3-1-5-2-4-8-6-5/h2,4,7H,1,3H2
InChIKeyXLTIRSFEVCKSMY-UHFFFAOYSA-N
MW129.18 g/mol
LogP0.68
Rot. Bonds2

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

2-(1,2-thiazol-3-yl)ethanol (PubChem CID 20550112) has the molecular formula C5H7NOS and a molecular weight of 129.18 g/mol. Its IUPAC name is 2-(1,2-thiazol-3-yl)ethanol.

Molecular Properties

Compound Name2-(1,2-thiazol-3-yl)ethanol
PubChem CID20550112
Molecular FormulaC5H7NOS
Molecular Weight129.18 g/mol
Exact Mass129.02
IUPAC Name2-(1,2-thiazol-3-yl)ethanol
SMILESOCCc1ccsn1
InChIInChI=1S/C5H7NOS/c7-3-1-5-2-4-8-6-5/h2,4,7H,1,3H2
InChIKeyXLTIRSFEVCKSMY-UHFFFAOYSA-N
XLogP0.68
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.18
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,2-Thiazol-3-yl)acetic acid
CID 19979750
1-(Isothiazol-3-yl)ethanol
CID 19017861
4-Methyl-1-(1,2-thiazol-3-yl)pent-3-en-2-ol
CID 67596526
(1S)-1-(1,2-thiazol-3-yl)ethanol
CID 118480475
[1-Hydroxy-1-phosphono-2-(1,2-thiazol-3-yl)ethyl]phosphonic acid
CID 139650691
2-(1,2-Thiazol-3-yl)ethyl methanesulfonate
CID 172341341
4-(1,2-Thiazol-3-yl)butan-1-ol
CID 173009651
2-(1,2-Thiazol-3-yl)prop-2-ene-1,1-diol
CID 174596481
2-(1,2-Thiazol-3-yl)ethyl formate
CID 175007477
3-(1,2-Thiazol-3-yl)butan-2-ol
CID 130711256
3-(Oxiran-2-ylmethyl)-1,2-thiazole
CID 130752195
1-(1,2-Thiazol-3-yl)but-3-en-1-ol
CID 131160225

Frequently Asked Questions

What is the IUPAC name of 2-(1,2-thiazol-3-yl)ethanol?
The IUPAC name of 2-(1,2-thiazol-3-yl)ethanol (CID 20550112) is 2-(1,2-thiazol-3-yl)ethanol.
What is the SMILES notation for 2-(1,2-thiazol-3-yl)ethanol?
The canonical SMILES for 2-(1,2-thiazol-3-yl)ethanol is OCCc1ccsn1.
What is the InChIKey of 2-(1,2-thiazol-3-yl)ethanol?
The InChIKey is XLTIRSFEVCKSMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NOS/c7-3-1-5-2-4-8-6-5/h2,4,7H,1,3H2.
What are the key properties of 2-(1,2-thiazol-3-yl)ethanol?
2-(1,2-thiazol-3-yl)ethanol has a molecular weight of 129.18 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-thiazol-3-yl)ethanol is sourced from PubChem (CID 20550112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).