2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol

C5H9NO2S — CID 174246740

IUPAC2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol
SMILESOCCOC1=NCCS1
InChIInChI=1S/C5H9NO2S/c7-2-3-8-5-6-1-4-9-5/h7H,1-4H2
InChIKeyQCQBKKSGOSRGRF-UHFFFAOYSA-N
MW147.20 g/mol
LogP0.10
Rot. Bonds2

About 2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol

2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol (PubChem CID 174246740) has the molecular formula C5H9NO2S and a molecular weight of 147.20 g/mol. Its IUPAC name is 2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol.

Molecular Properties

Compound Name2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol
PubChem CID174246740
Molecular FormulaC5H9NO2S
Molecular Weight147.20 g/mol
Exact Mass147.04
IUPAC Name2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol
SMILESOCCOC1=NCCS1
InChIInChI=1S/C5H9NO2S/c7-2-3-8-5-6-1-4-9-5/h7H,1-4H2
InChIKeyQCQBKKSGOSRGRF-UHFFFAOYSA-N
XLogP0.10
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.20
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol?
The IUPAC name of 2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol (CID 174246740) is 2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol.
What is the SMILES notation for 2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol?
The canonical SMILES for 2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol is OCCOC1=NCCS1.
What is the InChIKey of 2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol?
The InChIKey is QCQBKKSGOSRGRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO2S/c7-2-3-8-5-6-1-4-9-5/h7H,1-4H2.
What are the key properties of 2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol?
2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol has a molecular weight of 147.20 g/mol, XLogP of 0.10, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dihydro-1,3-thiazol-2-yloxy)ethanol is sourced from PubChem (CID 174246740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).