2-(fluoromethyl)-4-methyl-1,3-oxazole

C5H6FNO — CID 174878136

IUPAC2-(fluoromethyl)-4-methyl-1,3-oxazole
SMILESCc1coc(CF)n1
InChIInChI=1S/C5H6FNO/c1-4-3-8-5(2-6)7-4/h3H,2H2,1H3
InChIKeyGLJSZGJNXLBYAV-UHFFFAOYSA-N
MW115.11 g/mol
LogP1.45
Rot. Bonds1

About 2-(fluoromethyl)-4-methyl-1,3-oxazole

2-(fluoromethyl)-4-methyl-1,3-oxazole (PubChem CID 174878136) has the molecular formula C5H6FNO and a molecular weight of 115.11 g/mol. Its IUPAC name is 2-(fluoromethyl)-4-methyl-1,3-oxazole.

Molecular Properties

Compound Name2-(fluoromethyl)-4-methyl-1,3-oxazole
PubChem CID174878136
Molecular FormulaC5H6FNO
Molecular Weight115.11 g/mol
Exact Mass115.04
IUPAC Name2-(fluoromethyl)-4-methyl-1,3-oxazole
SMILESCc1coc(CF)n1
InChIInChI=1S/C5H6FNO/c1-4-3-8-5(2-6)7-4/h3H,2H2,1H3
InChIKeyGLJSZGJNXLBYAV-UHFFFAOYSA-N
XLogP1.45
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.11
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-4-methyl-1,3-oxazole?
The IUPAC name of 2-(fluoromethyl)-4-methyl-1,3-oxazole (CID 174878136) is 2-(fluoromethyl)-4-methyl-1,3-oxazole.
What is the SMILES notation for 2-(fluoromethyl)-4-methyl-1,3-oxazole?
The canonical SMILES for 2-(fluoromethyl)-4-methyl-1,3-oxazole is Cc1coc(CF)n1.
What is the InChIKey of 2-(fluoromethyl)-4-methyl-1,3-oxazole?
The InChIKey is GLJSZGJNXLBYAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6FNO/c1-4-3-8-5(2-6)7-4/h3H,2H2,1H3.
What are the key properties of 2-(fluoromethyl)-4-methyl-1,3-oxazole?
2-(fluoromethyl)-4-methyl-1,3-oxazole has a molecular weight of 115.11 g/mol, XLogP of 1.45, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-4-methyl-1,3-oxazole is sourced from PubChem (CID 174878136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).