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

C12H12N2O2S — CID 770967

IUPAC2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide
SMILESCOc1ccc(CC(=O)Nc2nccs2)cc1
InChIInChI=1S/C12H12N2O2S/c1-16-10-4-2-9(3-5-10)8-11(15)14-12-13-6-7-17-12/h2-7H,8H2,1H3,(H,13,14,15)
InChIKeySPAPWVUPZKTBMH-UHFFFAOYSA-N
MW248.31 g/mol
LogP2.33
Rot. Bonds4

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

2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 770967) has the molecular formula C12H12N2O2S and a molecular weight of 248.31 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide
PubChem CID770967
Molecular FormulaC12H12N2O2S
Molecular Weight248.31 g/mol
Exact Mass248.06
IUPAC Name2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide
SMILESCOc1ccc(CC(=O)Nc2nccs2)cc1
InChIInChI=1S/C12H12N2O2S/c1-16-10-4-2-9(3-5-10)8-11(15)14-12-13-6-7-17-12/h2-7H,8H2,1H3,(H,13,14,15)
InChIKeySPAPWVUPZKTBMH-UHFFFAOYSA-N
XLogP2.33
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-(4-methoxyphenyl)-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]acetamide
CID 814252
2-(3,4-dimethoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide
CID 648788
2-[4-(difluoromethoxy)phenyl]-N-(1,3-thiazol-2-yl)acetamide
CID 33234261
2-(4-bromophenyl)-N-(1,3-thiazol-2-yl)acetamide
CID 669868
2-(4-methoxyphenyl)-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide
CID 8795536
2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 16879227
4-methoxy-N-[4-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]-1,3-thiazol-2-yl]benzamide
CID 41213386
N-(4-methoxyphenyl)-N'-(1,3-thiazol-2-yl)oxamide
CID 45000900
N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-2-(4-methoxyphenyl)acetamide
CID 35540738
N-[4-(1-hydroxyethyl)-1,3-thiazol-2-yl]-2-(4-methoxyphenyl)acetamide
CID 64545259
2-[5-hydroxy-1-[(4-methoxyphenyl)methyl]-3,4-dimethylpyrrol-2-yl]oxy-N-(1,3-thiazol-2-yl)acetamide
CID 91509895
2-[[5-[(4-methoxyphenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1,3-thiazol-2-yl)acetamide
CID 1085386

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide (CID 770967) is 2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide is COc1ccc(CC(=O)Nc2nccs2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is SPAPWVUPZKTBMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2S/c1-16-10-4-2-9(3-5-10)8-11(15)14-12-13-6-7-17-12/h2-7H,8H2,1H3,(H,13,14,15).
What are the key properties of 2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide?
2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 248.31 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 770967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).