5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole

C10H12FN3O — CID 70851824

IUPAC5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole
SMILESCCn1nc(-c2cnc(C)o2)c(F)c1C
InChIInChI=1S/C10H12FN3O/c1-4-14-6(2)9(11)10(13-14)8-5-12-7(3)15-8/h5H,4H2,1-3H3
InChIKeyVQWVWWBGUJSGMD-UHFFFAOYSA-N
MW209.22 g/mol
LogP2.31
Rot. Bonds2

About 5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole

5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole (PubChem CID 70851824) has the molecular formula C10H12FN3O and a molecular weight of 209.22 g/mol. Its IUPAC name is 5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole.

Molecular Properties

Compound Name5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole
PubChem CID70851824
Molecular FormulaC10H12FN3O
Molecular Weight209.22 g/mol
Exact Mass209.10
IUPAC Name5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole
SMILESCCn1nc(-c2cnc(C)o2)c(F)c1C
InChIInChI=1S/C10H12FN3O/c1-4-14-6(2)9(11)10(13-14)8-5-12-7(3)15-8/h5H,4H2,1-3H3
InChIKeyVQWVWWBGUJSGMD-UHFFFAOYSA-N
XLogP2.31
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole?
The IUPAC name of 5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole (CID 70851824) is 5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole.
What is the SMILES notation for 5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole?
The canonical SMILES for 5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole is CCn1nc(-c2cnc(C)o2)c(F)c1C.
What is the InChIKey of 5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole?
The InChIKey is VQWVWWBGUJSGMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3O/c1-4-14-6(2)9(11)10(13-14)8-5-12-7(3)15-8/h5H,4H2,1-3H3.
What are the key properties of 5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole?
5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole has a molecular weight of 209.22 g/mol, XLogP of 2.31, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-2-methyl-1,3-oxazole is sourced from PubChem (CID 70851824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).