2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide

C18H17N3O3S — CID 17468761

IUPAC2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide
SMILESCOc1ccc(-c2nc(CC(=O)Nc3ccc(OC)nc3)cs2)cc1
InChIInChI=1S/C18H17N3O3S/c1-23-15-6-3-12(4-7-15)18-21-14(11-25-18)9-16(22)20-13-5-8-17(24-2)19-10-13/h3-8,10-11H,9H2,1-2H3,(H,20,22)
InChIKeyHWZFWGHECOZDKT-UHFFFAOYSA-N
MW355.42 g/mol
LogP3.40
Rot. Bonds6

About 2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide

2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide (PubChem CID 17468761) has the molecular formula C18H17N3O3S and a molecular weight of 355.42 g/mol. Its IUPAC name is 2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide
PubChem CID17468761
Molecular FormulaC18H17N3O3S
Molecular Weight355.42 g/mol
Exact Mass355.10
IUPAC Name2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide
SMILESCOc1ccc(-c2nc(CC(=O)Nc3ccc(OC)nc3)cs2)cc1
InChIInChI=1S/C18H17N3O3S/c1-23-15-6-3-12(4-7-15)18-21-14(11-25-18)9-16(22)20-13-5-8-17(24-2)19-10-13/h3-8,10-11H,9H2,1-2H3,(H,20,22)
InChIKeyHWZFWGHECOZDKT-UHFFFAOYSA-N
XLogP3.40
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.42
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide?
The IUPAC name of 2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide (CID 17468761) is 2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide.
What is the SMILES notation for 2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide?
The canonical SMILES for 2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide is COc1ccc(-c2nc(CC(=O)Nc3ccc(OC)nc3)cs2)cc1.
What is the InChIKey of 2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide?
The InChIKey is HWZFWGHECOZDKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3S/c1-23-15-6-3-12(4-7-15)18-21-14(11-25-18)9-16(22)20-13-5-8-17(24-2)19-10-13/h3-8,10-11H,9H2,1-2H3,(H,20,22).
What are the key properties of 2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide?
2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide has a molecular weight of 355.42 g/mol, XLogP of 3.40, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methoxy-3-pyridinyl)acetamide is sourced from PubChem (CID 17468761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).