2-(4-tert-butylphenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide

C15H20N2O2S — CID 1284605

IUPAC2-(4-tert-butylphenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide
SMILESCC(C)(C)c1ccc(OCC(=O)NC2=NCCS2)cc1
InChIInChI=1S/C15H20N2O2S/c1-15(2,3)11-4-6-12(7-5-11)19-10-13(18)17-14-16-8-9-20-14/h4-7H,8-10H2,1-3H3,(H,16,17,18)
InChIKeyPQDZSUPHJVUVJK-UHFFFAOYSA-N
MW292.40 g/mol
LogP2.58
Rot. Bonds3

About 2-(4-tert-butylphenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide

2-(4-tert-butylphenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide (PubChem CID 1284605) has the molecular formula C15H20N2O2S and a molecular weight of 292.40 g/mol. Its IUPAC name is 2-(4-tert-butylphenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-tert-butylphenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide
PubChem CID1284605
Molecular FormulaC15H20N2O2S
Molecular Weight292.40 g/mol
Exact Mass292.12
IUPAC Name2-(4-tert-butylphenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide
SMILESCC(C)(C)c1ccc(OCC(=O)NC2=NCCS2)cc1
InChIInChI=1S/C15H20N2O2S/c1-15(2,3)11-4-6-12(7-5-11)19-10-13(18)17-14-16-8-9-20-14/h4-7H,8-10H2,1-3H3,(H,16,17,18)
InChIKeyPQDZSUPHJVUVJK-UHFFFAOYSA-N
XLogP2.58
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 52.58
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-(4,5-dihydro-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(4-tert-butylphenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide (CID 1284605) is 2-(4-tert-butylphenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(4-tert-butylphenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(4-tert-butylphenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide is CC(C)(C)c1ccc(OCC(=O)NC2=NCCS2)cc1.
What is the InChIKey of 2-(4-tert-butylphenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide?
The InChIKey is PQDZSUPHJVUVJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2S/c1-15(2,3)11-4-6-12(7-5-11)19-10-13(18)17-14-16-8-9-20-14/h4-7H,8-10H2,1-3H3,(H,16,17,18).
What are the key properties of 2-(4-tert-butylphenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide?
2-(4-tert-butylphenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide has a molecular weight of 292.40 g/mol, XLogP of 2.58, 3 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-(4,5-dihydro-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 1284605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).