2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide

C14H14ClFN2O2 — CID 134706391

IUPAC2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide
SMILESCCc1c(C)noc1NC(=O)Cc1ccc(F)cc1Cl
InChIInChI=1S/C14H14ClFN2O2/c1-3-11-8(2)18-20-14(11)17-13(19)6-9-4-5-10(16)7-12(9)15/h4-5,7H,3,6H2,1-2H3,(H,17,19)
InChIKeyUQKNSGIAQSOHNM-UHFFFAOYSA-N
MW296.73 g/mol
LogP3.52
Rot. Bonds4

About 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide

2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide (PubChem CID 134706391) has the molecular formula C14H14ClFN2O2 and a molecular weight of 296.73 g/mol. Its IUPAC name is 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide
PubChem CID134706391
Molecular FormulaC14H14ClFN2O2
Molecular Weight296.73 g/mol
Exact Mass296.07
IUPAC Name2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide
SMILESCCc1c(C)noc1NC(=O)Cc1ccc(F)cc1Cl
InChIInChI=1S/C14H14ClFN2O2/c1-3-11-8(2)18-20-14(11)17-13(19)6-9-4-5-10(16)7-12(9)15/h4-5,7H,3,6H2,1-2H3,(H,17,19)
InChIKeyUQKNSGIAQSOHNM-UHFFFAOYSA-N
XLogP3.52
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.73
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-5-sulfamoylphenyl)acetamide
CID 167215417
2-(benzotriazol-2-yl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide
CID 134711235
2-(2-chloro-4-fluorophenyl)-N-(6-chloropyridazin-4-yl)acetamide
CID 162428281
2-(4-chlorophenyl)sulfonyl-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-2-methylpropanamide
CID 58198557
N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)-1-(2-fluorophenyl)cyclopropane-1-carboxamide
CID 134706373
2-(2-chloro-4-fluorophenyl)-N-(cyanomethyl)acetamide
CID 126773085
2-(2-chloro-4-fluorophenyl)-N-[4-[(5-fluoro-2-pyridinyl)oxymethyl]-3-methylphenyl]acetamide
CID 167200495
3-[(2-chloro-4-fluorophenyl)methylsulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 34946052
N-[(2-chloro-4-fluorophenyl)methyl]-2-[1-(3-chlorophenyl)-3,5-dimethylpyrazol-4-yl]acetamide
CID 25106746
2-(2-chloro-4-fluorophenyl)-N-[1-(diethylaminomethyl)cyclopropyl]acetamide
CID 122570747
N-[4-(4-fluorophenyl)-3-methyl-1,2-oxazol-5-yl]-2-(5-methyl-1H-1,2,4-triazol-3-yl)acetamide
CID 155916599
N-(2,4-difluorophenyl)-2-[(S)-(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfinyl]acetamide
CID 95599370

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide?
The IUPAC name of 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide (CID 134706391) is 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide.
What is the SMILES notation for 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide?
The canonical SMILES for 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide is CCc1c(C)noc1NC(=O)Cc1ccc(F)cc1Cl.
What is the InChIKey of 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide?
The InChIKey is UQKNSGIAQSOHNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClFN2O2/c1-3-11-8(2)18-20-14(11)17-13(19)6-9-4-5-10(16)7-12(9)15/h4-5,7H,3,6H2,1-2H3,(H,17,19).
What are the key properties of 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide?
2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide has a molecular weight of 296.73 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-fluorophenyl)-N-(4-ethyl-3-methyl-1,2-oxazol-5-yl)acetamide is sourced from PubChem (CID 134706391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).