1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol

C8H11NOS — CID 64543111

IUPAC1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol
SMILESCC(O)c1csc(C2CC2)n1
InChIInChI=1S/C8H11NOS/c1-5(10)7-4-11-8(9-7)6-2-3-6/h4-6,10H,2-3H2,1H3
InChIKeyHNLPYAMSZVGBFC-UHFFFAOYSA-N
MW169.25 g/mol
LogP2.07
Rot. Bonds2

About 1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol

1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol (PubChem CID 64543111) has the molecular formula C8H11NOS and a molecular weight of 169.25 g/mol. Its IUPAC name is 1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol.

Molecular Properties

Compound Name1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol
PubChem CID64543111
Molecular FormulaC8H11NOS
Molecular Weight169.25 g/mol
Exact Mass169.06
IUPAC Name1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol
SMILESCC(O)c1csc(C2CC2)n1
InChIInChI=1S/C8H11NOS/c1-5(10)7-4-11-8(9-7)6-2-3-6/h4-6,10H,2-3H2,1H3
InChIKeyHNLPYAMSZVGBFC-UHFFFAOYSA-N
XLogP2.07
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol?
The IUPAC name of 1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol (CID 64543111) is 1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol.
What is the SMILES notation for 1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol?
The canonical SMILES for 1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol is CC(O)c1csc(C2CC2)n1.
What is the InChIKey of 1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol?
The InChIKey is HNLPYAMSZVGBFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NOS/c1-5(10)7-4-11-8(9-7)6-2-3-6/h4-6,10H,2-3H2,1H3.
What are the key properties of 1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol?
1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol has a molecular weight of 169.25 g/mol, XLogP of 2.07, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopropyl-1,3-thiazol-4-yl)ethanol is sourced from PubChem (CID 64543111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).