2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide

C12H10ClFN2O2 — CID 974105

IUPAC2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(NC(=O)Cc2c(F)cccc2Cl)no1
InChIInChI=1S/C12H10ClFN2O2/c1-7-5-11(16-18-7)15-12(17)6-8-9(13)3-2-4-10(8)14/h2-5H,6H2,1H3,(H,15,16,17)
InChIKeyFLFXWNMZULLZNC-UHFFFAOYSA-N
MW268.68 g/mol
LogP2.96
Rot. Bonds3

About 2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide

2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide (PubChem CID 974105) has the molecular formula C12H10ClFN2O2 and a molecular weight of 268.68 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
PubChem CID974105
Molecular FormulaC12H10ClFN2O2
Molecular Weight268.68 g/mol
Exact Mass268.04
IUPAC Name2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(NC(=O)Cc2c(F)cccc2Cl)no1
InChIInChI=1S/C12H10ClFN2O2/c1-7-5-11(16-18-7)15-12(17)6-8-9(13)3-2-4-10(8)14/h2-5H,6H2,1H3,(H,15,16,17)
InChIKeyFLFXWNMZULLZNC-UHFFFAOYSA-N
XLogP2.96
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.68
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide (CID 974105) is 2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide is Cc1cc(NC(=O)Cc2c(F)cccc2Cl)no1.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The InChIKey is FLFXWNMZULLZNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClFN2O2/c1-7-5-11(16-18-7)15-12(17)6-8-9(13)3-2-4-10(8)14/h2-5H,6H2,1H3,(H,15,16,17).
What are the key properties of 2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide has a molecular weight of 268.68 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 974105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).