[5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine

C10H13FN4O — CID 71055534

IUPAC[5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine
SMILESCCn1nc(-c2cnc(CN)o2)c(F)c1C
InChIInChI=1S/C10H13FN4O/c1-3-15-6(2)9(11)10(14-15)7-5-13-8(4-12)16-7/h5H,3-4,12H2,1-2H3
InChIKeyFPGCZPKXAWNJIZ-UHFFFAOYSA-N
MW224.24 g/mol
LogP1.46
Rot. Bonds3

About [5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine

[5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine (PubChem CID 71055534) has the molecular formula C10H13FN4O and a molecular weight of 224.24 g/mol. Its IUPAC name is [5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine.

Molecular Properties

Compound Name[5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine
PubChem CID71055534
Molecular FormulaC10H13FN4O
Molecular Weight224.24 g/mol
Exact Mass224.11
IUPAC Name[5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine
SMILESCCn1nc(-c2cnc(CN)o2)c(F)c1C
InChIInChI=1S/C10H13FN4O/c1-3-15-6(2)9(11)10(14-15)7-5-13-8(4-12)16-7/h5H,3-4,12H2,1-2H3
InChIKeyFPGCZPKXAWNJIZ-UHFFFAOYSA-N
XLogP1.46
TPSA69.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.24
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine?
The IUPAC name of [5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine (CID 71055534) is [5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine.
What is the SMILES notation for [5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine?
The canonical SMILES for [5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine is CCn1nc(-c2cnc(CN)o2)c(F)c1C.
What is the InChIKey of [5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine?
The InChIKey is FPGCZPKXAWNJIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN4O/c1-3-15-6(2)9(11)10(14-15)7-5-13-8(4-12)16-7/h5H,3-4,12H2,1-2H3.
What are the key properties of [5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine?
[5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine has a molecular weight of 224.24 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1-ethyl-4-fluoro-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]methanamine is sourced from PubChem (CID 71055534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).