2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide

C20H20N2O3S — CID 27167216

IUPAC2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
SMILESCCOc1ccccc1OCC(=O)Nc1ccc(-c2csc(C)n2)cc1
InChIInChI=1S/C20H20N2O3S/c1-3-24-18-6-4-5-7-19(18)25-12-20(23)22-16-10-8-15(9-11-16)17-13-26-14(2)21-17/h4-11,13H,3,12H2,1-2H3,(H,22,23)
InChIKeyPODRKDXGWSLKCM-UHFFFAOYSA-N
MW368.46 g/mol
LogP4.53
Rot. Bonds7

About 2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide

2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide (PubChem CID 27167216) has the molecular formula C20H20N2O3S and a molecular weight of 368.46 g/mol. Its IUPAC name is 2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
PubChem CID27167216
Molecular FormulaC20H20N2O3S
Molecular Weight368.46 g/mol
Exact Mass368.12
IUPAC Name2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
SMILESCCOc1ccccc1OCC(=O)Nc1ccc(-c2csc(C)n2)cc1
InChIInChI=1S/C20H20N2O3S/c1-3-24-18-6-4-5-7-19(18)25-12-20(23)22-16-10-8-15(9-11-16)17-13-26-14(2)21-17/h4-11,13H,3,12H2,1-2H3,(H,22,23)
InChIKeyPODRKDXGWSLKCM-UHFFFAOYSA-N
XLogP4.53
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.46
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide?
The IUPAC name of 2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide (CID 27167216) is 2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide.
What is the SMILES notation for 2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide?
The canonical SMILES for 2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide is CCOc1ccccc1OCC(=O)Nc1ccc(-c2csc(C)n2)cc1.
What is the InChIKey of 2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide?
The InChIKey is PODRKDXGWSLKCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O3S/c1-3-24-18-6-4-5-7-19(18)25-12-20(23)22-16-10-8-15(9-11-16)17-13-26-14(2)21-17/h4-11,13H,3,12H2,1-2H3,(H,22,23).
What are the key properties of 2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide?
2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide has a molecular weight of 368.46 g/mol, XLogP of 4.53, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyphenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide is sourced from PubChem (CID 27167216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).