N-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide

C6H7FN2O3 — CID 131102028

IUPACN-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide
SMILESO=C(NCCF)c1cc(=O)[nH]o1
InChIInChI=1S/C6H7FN2O3/c7-1-2-8-6(11)4-3-5(10)9-12-4/h3H,1-2H2,(H,8,11)(H,9,10)
InChIKeyMOIPZUVLKGFPBI-UHFFFAOYSA-N
MW174.13 g/mol
LogP-0.33
Rot. Bonds3

About N-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide

N-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide (PubChem CID 131102028) has the molecular formula C6H7FN2O3 and a molecular weight of 174.13 g/mol. Its IUPAC name is N-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide
PubChem CID131102028
Molecular FormulaC6H7FN2O3
Molecular Weight174.13 g/mol
Exact Mass174.04
IUPAC NameN-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide
SMILESO=C(NCCF)c1cc(=O)[nH]o1
InChIInChI=1S/C6H7FN2O3/c7-1-2-8-6(11)4-3-5(10)9-12-4/h3H,1-2H2,(H,8,11)(H,9,10)
InChIKeyMOIPZUVLKGFPBI-UHFFFAOYSA-N
XLogP-0.33
TPSA75.10 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.13
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(2-fluoroethyl)-5-methyl-1H-pyrazole-3-carboxamide
CID 130978682
4-fluoro-N-(2-fluoroethyl)benzamide
CID 130478179
N-(2-fluoroethyl)-5-hydrazinylpyrazine-2-carboxamide
CID 130504959
N-(2-fluoroethyl)-2,5-dihydroxybenzamide
CID 130504504
2-chloro-N-(2-fluoroethyl)-5-sulfanylbenzamide
CID 130505013
4-amino-N-(2-fluoroethyl)thiophene-2-carboxamide
CID 130922992
N-(2-fluoroethyl)-2,3-dihydroxybenzamide
CID 130478170
N-(2-fluoroethyl)-4-iodo-1H-pyrazole-5-carboxamide
CID 130614280
ethane;3-fluoro-N-(2-fluoroethyl)-4-methylbenzamide
CID 144686533
4-bromo-3-fluoro-N-(2-fluoroethyl)benzamide
CID 130478173
N-(2-fluoroethyl)-6-(methylamino)pyridazine-3-carboxamide
CID 130504947
3-(2-fluoroethylcarbamoyl)-2,4,6-trimethylbenzenesulfonyl chloride
CID 114267172

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide?
The IUPAC name of N-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide (CID 131102028) is N-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide is O=C(NCCF)c1cc(=O)[nH]o1.
What is the InChIKey of N-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide?
The InChIKey is MOIPZUVLKGFPBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FN2O3/c7-1-2-8-6(11)4-3-5(10)9-12-4/h3H,1-2H2,(H,8,11)(H,9,10).
What are the key properties of N-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide?
N-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide has a molecular weight of 174.13 g/mol, XLogP of -0.33, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 131102028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).