2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide

C15H18N2O2S — CID 710350

IUPAC2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
SMILESCC(C)(C)c1ccc(OCC(=O)Nc2nccs2)cc1
InChIInChI=1S/C15H18N2O2S/c1-15(2,3)11-4-6-12(7-5-11)19-10-13(18)17-14-16-8-9-20-14/h4-9H,10H2,1-3H3,(H,16,17,18)
InChIKeyAUZQBPGPFIDEJG-UHFFFAOYSA-N
MW290.39 g/mol
LogP3.46
Rot. Bonds4

About 2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide

2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 710350) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is 2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
PubChem CID710350
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC Name2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
SMILESCC(C)(C)c1ccc(OCC(=O)Nc2nccs2)cc1
InChIInChI=1S/C15H18N2O2S/c1-15(2,3)11-4-6-12(7-5-11)19-10-13(18)17-14-16-8-9-20-14/h4-9H,10H2,1-3H3,(H,16,17,18)
InChIKeyAUZQBPGPFIDEJG-UHFFFAOYSA-N
XLogP3.46
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide (CID 710350) is 2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide is CC(C)(C)c1ccc(OCC(=O)Nc2nccs2)cc1.
What is the InChIKey of 2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is AUZQBPGPFIDEJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-15(2,3)11-4-6-12(7-5-11)19-10-13(18)17-14-16-8-9-20-14/h4-9H,10H2,1-3H3,(H,16,17,18).
What are the key properties of 2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide?
2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 290.39 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenoxy)-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 710350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).