2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide

C12H12N2O2S — CID 110463122

IUPAC2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide
SMILESO=C(Cc1ccc(O)cc1)NCc1nccs1
InChIInChI=1S/C12H12N2O2S/c15-10-3-1-9(2-4-10)7-11(16)14-8-12-13-5-6-17-12/h1-6,15H,7-8H2,(H,14,16)
InChIKeyOXYBWEDANWXHNS-UHFFFAOYSA-N
MW248.31 g/mol
LogP1.71
Rot. Bonds4

About 2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide

2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide (PubChem CID 110463122) has the molecular formula C12H12N2O2S and a molecular weight of 248.31 g/mol. Its IUPAC name is 2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide
PubChem CID110463122
Molecular FormulaC12H12N2O2S
Molecular Weight248.31 g/mol
Exact Mass248.06
IUPAC Name2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide
SMILESO=C(Cc1ccc(O)cc1)NCc1nccs1
InChIInChI=1S/C12H12N2O2S/c15-10-3-1-9(2-4-10)7-11(16)14-8-12-13-5-6-17-12/h1-6,15H,7-8H2,(H,14,16)
InChIKeyOXYBWEDANWXHNS-UHFFFAOYSA-N
XLogP1.71
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methylphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 110738852
2-phenyl-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 110442320
2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide
CID 78806113
2,6-dihydroxy-N-(1,3-thiazol-2-ylmethyl)benzamide
CID 113346793
4-hydroxy-2-methyl-N-(1,3-thiazol-2-ylmethyl)benzamide
CID 113341365
3-amino-N-(1,3-thiazol-2-ylmethyl)propanamide
CID 61284856
3-bromo-N-(1,3-thiazol-2-ylmethyl)propanamide
CID 82110922
2-(4-oxo-3H-phthalazin-1-yl)-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 171679450
N-(1,3-thiazol-2-ylmethyl)pentanamide
CID 67124836
4-(1,3-thiazol-2-ylmethylcarbamoyl)benzoic acid
CID 54962478
2-amino-N-[2-oxo-2-(1,3-thiazol-2-ylmethylamino)ethyl]acetamide
CID 61284260
ethane;N-(1,3-thiazol-2-ylmethyl)acetamide
CID 177244063

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide?
The IUPAC name of 2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide (CID 110463122) is 2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide?
The canonical SMILES for 2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide is O=C(Cc1ccc(O)cc1)NCc1nccs1.
What is the InChIKey of 2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide?
The InChIKey is OXYBWEDANWXHNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2S/c15-10-3-1-9(2-4-10)7-11(16)14-8-12-13-5-6-17-12/h1-6,15H,7-8H2,(H,14,16).
What are the key properties of 2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide?
2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide has a molecular weight of 248.31 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide is sourced from PubChem (CID 110463122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).