2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine

C12H17NOS — CID 66244736

IUPAC2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine
SMILESCCOc1ccccc1C1NCC(C)S1
InChIInChI=1S/C12H17NOS/c1-3-14-11-7-5-4-6-10(11)12-13-8-9(2)15-12/h4-7,9,12-13H,3,8H2,1-2H3
InChIKeyRZIMHJKRAZKAFM-UHFFFAOYSA-N
MW223.34 g/mol
LogP2.81
Rot. Bonds3

About 2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine

2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine (PubChem CID 66244736) has the molecular formula C12H17NOS and a molecular weight of 223.34 g/mol. Its IUPAC name is 2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine.

Molecular Properties

Compound Name2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine
PubChem CID66244736
Molecular FormulaC12H17NOS
Molecular Weight223.34 g/mol
Exact Mass223.10
IUPAC Name2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine
SMILESCCOc1ccccc1C1NCC(C)S1
InChIInChI=1S/C12H17NOS/c1-3-14-11-7-5-4-6-10(11)12-13-8-9(2)15-12/h4-7,9,12-13H,3,8H2,1-2H3
InChIKeyRZIMHJKRAZKAFM-UHFFFAOYSA-N
XLogP2.81
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.34
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine?
The IUPAC name of 2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine (CID 66244736) is 2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine.
What is the SMILES notation for 2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine?
The canonical SMILES for 2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine is CCOc1ccccc1C1NCC(C)S1.
What is the InChIKey of 2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine?
The InChIKey is RZIMHJKRAZKAFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NOS/c1-3-14-11-7-5-4-6-10(11)12-13-8-9(2)15-12/h4-7,9,12-13H,3,8H2,1-2H3.
What are the key properties of 2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine?
2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine has a molecular weight of 223.34 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyphenyl)-5-methyl-1,3-thiazolidine is sourced from PubChem (CID 66244736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).