2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide

C17H15N3O2S — CID 146661408

IUPAC2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide
SMILESCc1ccc(OCC(=O)N(c2ccccn2)c2nccs2)cc1
InChIInChI=1S/C17H15N3O2S/c1-13-5-7-14(8-6-13)22-12-16(21)20(17-19-10-11-23-17)15-4-2-3-9-18-15/h2-11H,12H2,1H3
InChIKeyPJIPTWGUVSZVFR-UHFFFAOYSA-N
MW325.39 g/mol
LogP3.59
Rot. Bonds5

About 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide

2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 146661408) has the molecular formula C17H15N3O2S and a molecular weight of 325.39 g/mol. Its IUPAC name is 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide
PubChem CID146661408
Molecular FormulaC17H15N3O2S
Molecular Weight325.39 g/mol
Exact Mass325.09
IUPAC Name2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide
SMILESCc1ccc(OCC(=O)N(c2ccccn2)c2nccs2)cc1
InChIInChI=1S/C17H15N3O2S/c1-13-5-7-14(8-6-13)22-12-16(21)20(17-19-10-11-23-17)15-4-2-3-9-18-15/h2-11H,12H2,1H3
InChIKeyPJIPTWGUVSZVFR-UHFFFAOYSA-N
XLogP3.59
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide (CID 146661408) is 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide is Cc1ccc(OCC(=O)N(c2ccccn2)c2nccs2)cc1.
What is the InChIKey of 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is PJIPTWGUVSZVFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2S/c1-13-5-7-14(8-6-13)22-12-16(21)20(17-19-10-11-23-17)15-4-2-3-9-18-15/h2-11H,12H2,1H3.
What are the key properties of 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide?
2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 325.39 g/mol, XLogP of 3.59, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenoxy)-N-pyridin-2-yl-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 146661408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).