2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide

C18H24N2O5S — CID 46008456

IUPAC2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide
SMILESCOCCN(Cc1csc(COc2ccccc2OC)n1)C(=O)COC
InChIInChI=1S/C18H24N2O5S/c1-22-9-8-20(18(21)12-23-2)10-14-13-26-17(19-14)11-25-16-7-5-4-6-15(16)24-3/h4-7,13H,8-12H2,1-3H3
InChIKeyOTKGGHRMGBFYJN-UHFFFAOYSA-N
MW380.47 g/mol
LogP2.35
Rot. Bonds11

About 2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide

2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide (PubChem CID 46008456) has the molecular formula C18H24N2O5S and a molecular weight of 380.47 g/mol. Its IUPAC name is 2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide
PubChem CID46008456
Molecular FormulaC18H24N2O5S
Molecular Weight380.47 g/mol
Exact Mass380.14
IUPAC Name2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide
SMILESCOCCN(Cc1csc(COc2ccccc2OC)n1)C(=O)COC
InChIInChI=1S/C18H24N2O5S/c1-22-9-8-20(18(21)12-23-2)10-14-13-26-17(19-14)11-25-16-7-5-4-6-15(16)24-3/h4-7,13H,8-12H2,1-3H3
InChIKeyOTKGGHRMGBFYJN-UHFFFAOYSA-N
XLogP2.35
TPSA70.12 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.47
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide?
The IUPAC name of 2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide (CID 46008456) is 2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide.
What is the SMILES notation for 2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide?
The canonical SMILES for 2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide is COCCN(Cc1csc(COc2ccccc2OC)n1)C(=O)COC.
What is the InChIKey of 2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide?
The InChIKey is OTKGGHRMGBFYJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O5S/c1-22-9-8-20(18(21)12-23-2)10-14-13-26-17(19-14)11-25-16-7-5-4-6-15(16)24-3/h4-7,13H,8-12H2,1-3H3.
What are the key properties of 2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide?
2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide has a molecular weight of 380.47 g/mol, XLogP of 2.35, 11 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(2-methoxyethyl)-N-[[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]acetamide is sourced from PubChem (CID 46008456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).