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

C8H11NOS — CID 130736308

IUPAC2-cyclopropyl-1-(1,2-thiazol-3-yl)ethanol
SMILESOC(CC1CC1)c1ccsn1
InChIInChI=1S/C8H11NOS/c10-8(5-6-1-2-6)7-3-4-11-9-7/h3-4,6,8,10H,1-2,5H2
InChIKeyQDJMJYRJAHHKQD-UHFFFAOYSA-N
MW169.25 g/mol
LogP1.98
Rot. Bonds3

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

2-cyclopropyl-1-(1,2-thiazol-3-yl)ethanol (PubChem CID 130736308) has the molecular formula C8H11NOS and a molecular weight of 169.25 g/mol. Its IUPAC name is 2-cyclopropyl-1-(1,2-thiazol-3-yl)ethanol.

Molecular Properties

Compound Name2-cyclopropyl-1-(1,2-thiazol-3-yl)ethanol
PubChem CID130736308
Molecular FormulaC8H11NOS
Molecular Weight169.25 g/mol
Exact Mass169.06
IUPAC Name2-cyclopropyl-1-(1,2-thiazol-3-yl)ethanol
SMILESOC(CC1CC1)c1ccsn1
InChIInChI=1S/C8H11NOS/c10-8(5-6-1-2-6)7-3-4-11-9-7/h3-4,6,8,10H,1-2,5H2
InChIKeyQDJMJYRJAHHKQD-UHFFFAOYSA-N
XLogP1.98
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(1,2-thiazol-3-yl)ethanol?
The IUPAC name of 2-cyclopropyl-1-(1,2-thiazol-3-yl)ethanol (CID 130736308) is 2-cyclopropyl-1-(1,2-thiazol-3-yl)ethanol.
What is the SMILES notation for 2-cyclopropyl-1-(1,2-thiazol-3-yl)ethanol?
The canonical SMILES for 2-cyclopropyl-1-(1,2-thiazol-3-yl)ethanol is OC(CC1CC1)c1ccsn1.
What is the InChIKey of 2-cyclopropyl-1-(1,2-thiazol-3-yl)ethanol?
The InChIKey is QDJMJYRJAHHKQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NOS/c10-8(5-6-1-2-6)7-3-4-11-9-7/h3-4,6,8,10H,1-2,5H2.
What are the key properties of 2-cyclopropyl-1-(1,2-thiazol-3-yl)ethanol?
2-cyclopropyl-1-(1,2-thiazol-3-yl)ethanol has a molecular weight of 169.25 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(1,2-thiazol-3-yl)ethanol is sourced from PubChem (CID 130736308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).