2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol

C8H11NO3S — CID 130874794

IUPAC2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol
SMILESOC(CC1OCCO1)c1ccns1
InChIInChI=1S/C8H11NO3S/c10-6(7-1-2-9-13-7)5-8-11-3-4-12-8/h1-2,6,8,10H,3-5H2
InChIKeyBUOBNMKLFHHRSA-UHFFFAOYSA-N
MW201.25 g/mol
LogP0.94
Rot. Bonds3

About 2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol

2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol (PubChem CID 130874794) has the molecular formula C8H11NO3S and a molecular weight of 201.25 g/mol. Its IUPAC name is 2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol.

Molecular Properties

Compound Name2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol
PubChem CID130874794
Molecular FormulaC8H11NO3S
Molecular Weight201.25 g/mol
Exact Mass201.05
IUPAC Name2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol
SMILESOC(CC1OCCO1)c1ccns1
InChIInChI=1S/C8H11NO3S/c10-6(7-1-2-9-13-7)5-8-11-3-4-12-8/h1-2,6,8,10H,3-5H2
InChIKeyBUOBNMKLFHHRSA-UHFFFAOYSA-N
XLogP0.94
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.25
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

8-Isothiazol-5-yl-1,4-dioxa-spiro[4.5]decan-8-ol
CID 59361591
(2R,3S,4R,5R)-2-(hydroxymethyl)-5-(1,2-thiazol-5-yl)oxolane-3,4-diol
CID 156788784
(3-Methoxyoxolan-3-yl)-(1,2-thiazol-5-yl)methanol
CID 130802936
2,5-Dimethyl-3-(1,2-thiazol-5-yl)oxolan-3-ol
CID 130900900
(2-Methyloxolan-3-yl)-(1,2-thiazol-5-yl)methanol
CID 131001016
(2-Ethyloxolan-3-yl)-(1,2-thiazol-5-yl)methanol
CID 131003196
5-Ethyl-3-(1,2-thiazol-5-yl)oxolan-3-ol
CID 164652041

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol?
The IUPAC name of 2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol (CID 130874794) is 2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol.
What is the SMILES notation for 2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol?
The canonical SMILES for 2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol is OC(CC1OCCO1)c1ccns1.
What is the InChIKey of 2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol?
The InChIKey is BUOBNMKLFHHRSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO3S/c10-6(7-1-2-9-13-7)5-8-11-3-4-12-8/h1-2,6,8,10H,3-5H2.
What are the key properties of 2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol?
2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol has a molecular weight of 201.25 g/mol, XLogP of 0.94, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dioxolan-2-yl)-1-(1,2-thiazol-5-yl)ethanol is sourced from PubChem (CID 130874794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).