2-(4-chlorophenoxy)-4-methyl-1,3-thiazole

C10H8ClNOS — CID 117189244

IUPAC2-(4-chlorophenoxy)-4-methyl-1,3-thiazole
SMILESCc1csc(Oc2ccc(Cl)cc2)n1
InChIInChI=1S/C10H8ClNOS/c1-7-6-14-10(12-7)13-9-4-2-8(11)3-5-9/h2-6H,1H3
InChIKeyRHGQVYABRMMXBE-UHFFFAOYSA-N
MW225.70 g/mol
LogP3.90
Rot. Bonds2

About 2-(4-chlorophenoxy)-4-methyl-1,3-thiazole

2-(4-chlorophenoxy)-4-methyl-1,3-thiazole (PubChem CID 117189244) has the molecular formula C10H8ClNOS and a molecular weight of 225.70 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-4-methyl-1,3-thiazole.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-4-methyl-1,3-thiazole
PubChem CID117189244
Molecular FormulaC10H8ClNOS
Molecular Weight225.70 g/mol
Exact Mass225.00
IUPAC Name2-(4-chlorophenoxy)-4-methyl-1,3-thiazole
SMILESCc1csc(Oc2ccc(Cl)cc2)n1
InChIInChI=1S/C10H8ClNOS/c1-7-6-14-10(12-7)13-9-4-2-8(11)3-5-9/h2-6H,1H3
InChIKeyRHGQVYABRMMXBE-UHFFFAOYSA-N
XLogP3.90
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.70
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(4-Chlorophenoxy)methyl]-1,3-thiazol-2-amine
CID 3532154
4-Methyl-2-phenoxy-1,3-thiazole
CID 12787013
4-[(4-Chloro-2-fluorophenoxy)methyl]-1,3-thiazole
CID 156489145
2-(2-Fluoro-4-iodophenoxy)-4-methyl-1,3-thiazole
CID 169942676
Ethane;2-phenoxy-4-(trifluoromethyl)-1,3-thiazole
CID 176690970
4-Bromo-2-(3-chloro-4-fluorophenoxy)-1,3-thiazole
CID 79399607
2-[(4-Chloro-3-fluorophenoxy)methyl]-4-methyl-1,3-thiazole
CID 82705346
4-[(4-Chloro-3-fluorophenoxy)methyl]-2-ethyl-1,3-thiazole
CID 82705902
4-[(4-Chloro-3-fluorophenoxy)methyl]-1,3-thiazole
CID 82705907
4-[(4-Chloro-3-fluorophenoxy)methyl]-2-methyl-1,3-thiazole
CID 82705988
2-[4-(4-Chloro-3-fluorophenoxy)butyl]-4-(chloromethyl)-1,3-thiazole
CID 82716282
2-[(4-Chloro-3-fluorophenoxy)methyl]-4-(chloromethyl)-1,3-thiazole
CID 82716363

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-4-methyl-1,3-thiazole?
The IUPAC name of 2-(4-chlorophenoxy)-4-methyl-1,3-thiazole (CID 117189244) is 2-(4-chlorophenoxy)-4-methyl-1,3-thiazole.
What is the SMILES notation for 2-(4-chlorophenoxy)-4-methyl-1,3-thiazole?
The canonical SMILES for 2-(4-chlorophenoxy)-4-methyl-1,3-thiazole is Cc1csc(Oc2ccc(Cl)cc2)n1.
What is the InChIKey of 2-(4-chlorophenoxy)-4-methyl-1,3-thiazole?
The InChIKey is RHGQVYABRMMXBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClNOS/c1-7-6-14-10(12-7)13-9-4-2-8(11)3-5-9/h2-6H,1H3.
What are the key properties of 2-(4-chlorophenoxy)-4-methyl-1,3-thiazole?
2-(4-chlorophenoxy)-4-methyl-1,3-thiazole has a molecular weight of 225.70 g/mol, XLogP of 3.90, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-4-methyl-1,3-thiazole is sourced from PubChem (CID 117189244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).