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

C5H7NOS — CID 119029079

IUPAC1-(1,2-thiazol-5-yl)ethanol
SMILESCC(O)c1ccns1
InChIInChI=1S/C5H7NOS/c1-4(7)5-2-3-6-8-5/h2-4,7H,1H3
InChIKeyIBQOBJBPEDHKFL-UHFFFAOYSA-N
MW129.18 g/mol
LogP1.20
Rot. Bonds1

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

1-(1,2-thiazol-5-yl)ethanol (PubChem CID 119029079) has the molecular formula C5H7NOS and a molecular weight of 129.18 g/mol. Its IUPAC name is 1-(1,2-thiazol-5-yl)ethanol.

Molecular Properties

Compound Name1-(1,2-thiazol-5-yl)ethanol
PubChem CID119029079
Molecular FormulaC5H7NOS
Molecular Weight129.18 g/mol
Exact Mass129.02
IUPAC Name1-(1,2-thiazol-5-yl)ethanol
SMILESCC(O)c1ccns1
InChIInChI=1S/C5H7NOS/c1-4(7)5-2-3-6-8-5/h2-4,7H,1H3
InChIKeyIBQOBJBPEDHKFL-UHFFFAOYSA-N
XLogP1.20
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.18
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1,2-thiazol-5-yl)ethanol?
The IUPAC name of 1-(1,2-thiazol-5-yl)ethanol (CID 119029079) is 1-(1,2-thiazol-5-yl)ethanol.
What is the SMILES notation for 1-(1,2-thiazol-5-yl)ethanol?
The canonical SMILES for 1-(1,2-thiazol-5-yl)ethanol is CC(O)c1ccns1.
What is the InChIKey of 1-(1,2-thiazol-5-yl)ethanol?
The InChIKey is IBQOBJBPEDHKFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NOS/c1-4(7)5-2-3-6-8-5/h2-4,7H,1H3.
What are the key properties of 1-(1,2-thiazol-5-yl)ethanol?
1-(1,2-thiazol-5-yl)ethanol has a molecular weight of 129.18 g/mol, XLogP of 1.20, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-thiazol-5-yl)ethanol is sourced from PubChem (CID 119029079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).