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

C13H16N2O2S — CID 924633

IUPACN-(4,5-dihydro-1,3-thiazol-2-yl)-2-(4-ethylphenoxy)acetamide
SMILESCCc1ccc(OCC(=O)NC2=NCCS2)cc1
InChIInChI=1S/C13H16N2O2S/c1-2-10-3-5-11(6-4-10)17-9-12(16)15-13-14-7-8-18-13/h3-6H,2,7-9H2,1H3,(H,14,15,16)
InChIKeyRZZDLJJHLUJOKC-UHFFFAOYSA-N
MW264.35 g/mol
LogP1.85
Rot. Bonds4

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

N-(4,5-dihydro-1,3-thiazol-2-yl)-2-(4-ethylphenoxy)acetamide (PubChem CID 924633) has the molecular formula C13H16N2O2S and a molecular weight of 264.35 g/mol. Its IUPAC name is N-(4,5-dihydro-1,3-thiazol-2-yl)-2-(4-ethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(4,5-dihydro-1,3-thiazol-2-yl)-2-(4-ethylphenoxy)acetamide
PubChem CID924633
Molecular FormulaC13H16N2O2S
Molecular Weight264.35 g/mol
Exact Mass264.09
IUPAC NameN-(4,5-dihydro-1,3-thiazol-2-yl)-2-(4-ethylphenoxy)acetamide
SMILESCCc1ccc(OCC(=O)NC2=NCCS2)cc1
InChIInChI=1S/C13H16N2O2S/c1-2-10-3-5-11(6-4-10)17-9-12(16)15-13-14-7-8-18-13/h3-6H,2,7-9H2,1H3,(H,14,15,16)
InChIKeyRZZDLJJHLUJOKC-UHFFFAOYSA-N
XLogP1.85
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4,5-dihydro-1,3-thiazol-2-yl)-3-(4-ethylphenoxy)propanamide
CID 108795890
2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide
CID 9095297
2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide
CID 39107615
N-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide
CID 33152476
N-(4-ethylphenyl)-2-(4-fluorophenoxy)acetamide
CID 893586
2-(4-ethylphenoxy)-N-methoxyacetamide
CID 60716979
N-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide
CID 706860
2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide
CID 115680804
2-(2-bromo-4,6-dimethylphenoxy)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide
CID 924627
2-[4-[[2-(4-ethylphenoxy)acetyl]amino]phenyl]-N-methylacetamide
CID 35364935
N,N-diethyl-4-[[2-(4-ethylphenoxy)acetyl]amino]benzamide
CID 8503993
ethyl 2-[[2-(4-ethylphenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate
CID 28692626

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dihydro-1,3-thiazol-2-yl)-2-(4-ethylphenoxy)acetamide?
The IUPAC name of N-(4,5-dihydro-1,3-thiazol-2-yl)-2-(4-ethylphenoxy)acetamide (CID 924633) is N-(4,5-dihydro-1,3-thiazol-2-yl)-2-(4-ethylphenoxy)acetamide.
What is the SMILES notation for N-(4,5-dihydro-1,3-thiazol-2-yl)-2-(4-ethylphenoxy)acetamide?
The canonical SMILES for N-(4,5-dihydro-1,3-thiazol-2-yl)-2-(4-ethylphenoxy)acetamide is CCc1ccc(OCC(=O)NC2=NCCS2)cc1.
What is the InChIKey of N-(4,5-dihydro-1,3-thiazol-2-yl)-2-(4-ethylphenoxy)acetamide?
The InChIKey is RZZDLJJHLUJOKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2S/c1-2-10-3-5-11(6-4-10)17-9-12(16)15-13-14-7-8-18-13/h3-6H,2,7-9H2,1H3,(H,14,15,16).
What are the key properties of N-(4,5-dihydro-1,3-thiazol-2-yl)-2-(4-ethylphenoxy)acetamide?
N-(4,5-dihydro-1,3-thiazol-2-yl)-2-(4-ethylphenoxy)acetamide has a molecular weight of 264.35 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dihydro-1,3-thiazol-2-yl)-2-(4-ethylphenoxy)acetamide is sourced from PubChem (CID 924633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).