4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole

C11H10FNOS — CID 142639749

IUPAC4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole
SMILESFc1ccc(OCCc2cscn2)cc1
InChIInChI=1S/C11H10FNOS/c12-9-1-3-11(4-2-9)14-6-5-10-7-15-8-13-10/h1-4,7-8H,5-6H2
InChIKeyBRULQDPZWAUILS-UHFFFAOYSA-N
MW223.27 g/mol
LogP2.90
Rot. Bonds4

About 4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole

4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole (PubChem CID 142639749) has the molecular formula C11H10FNOS and a molecular weight of 223.27 g/mol. Its IUPAC name is 4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole.

Molecular Properties

Compound Name4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole
PubChem CID142639749
Molecular FormulaC11H10FNOS
Molecular Weight223.27 g/mol
Exact Mass223.05
IUPAC Name4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole
SMILESFc1ccc(OCCc2cscn2)cc1
InChIInChI=1S/C11H10FNOS/c12-9-1-3-11(4-2-9)14-6-5-10-7-15-8-13-10/h1-4,7-8H,5-6H2
InChIKeyBRULQDPZWAUILS-UHFFFAOYSA-N
XLogP2.90
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole?
The IUPAC name of 4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole (CID 142639749) is 4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole.
What is the SMILES notation for 4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole?
The canonical SMILES for 4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole is Fc1ccc(OCCc2cscn2)cc1.
What is the InChIKey of 4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole?
The InChIKey is BRULQDPZWAUILS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNOS/c12-9-1-3-11(4-2-9)14-6-5-10-7-15-8-13-10/h1-4,7-8H,5-6H2.
What are the key properties of 4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole?
4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole has a molecular weight of 223.27 g/mol, XLogP of 2.90, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole is sourced from PubChem (CID 142639749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).