2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide

C8H11FN2O2 — CID 130685788

IUPAC2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide
SMILESCC(C)C(F)C(=O)Nc1ccon1
InChIInChI=1S/C8H11FN2O2/c1-5(2)7(9)8(12)10-6-3-4-13-11-6/h3-5,7H,1-2H3,(H,10,11,12)
InChIKeyGCQNXPFYKCUSCT-UHFFFAOYSA-N
MW186.19 g/mol
LogP1.61
Rot. Bonds3

About 2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide

2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide (PubChem CID 130685788) has the molecular formula C8H11FN2O2 and a molecular weight of 186.19 g/mol. Its IUPAC name is 2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide.

Molecular Properties

Compound Name2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide
PubChem CID130685788
Molecular FormulaC8H11FN2O2
Molecular Weight186.19 g/mol
Exact Mass186.08
IUPAC Name2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide
SMILESCC(C)C(F)C(=O)Nc1ccon1
InChIInChI=1S/C8H11FN2O2/c1-5(2)7(9)8(12)10-6-3-4-13-11-6/h3-5,7H,1-2H3,(H,10,11,12)
InChIKeyGCQNXPFYKCUSCT-UHFFFAOYSA-N
XLogP1.61
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.19
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide?
The IUPAC name of 2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide (CID 130685788) is 2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide.
What is the SMILES notation for 2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide?
The canonical SMILES for 2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide is CC(C)C(F)C(=O)Nc1ccon1.
What is the InChIKey of 2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide?
The InChIKey is GCQNXPFYKCUSCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2O2/c1-5(2)7(9)8(12)10-6-3-4-13-11-6/h3-5,7H,1-2H3,(H,10,11,12).
What are the key properties of 2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide?
2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide has a molecular weight of 186.19 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-methyl-N-(1,2-oxazol-3-yl)butanamide is sourced from PubChem (CID 130685788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).