N'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide

C10H8FN3O2 — CID 2812135

IUPACN'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide
SMILESO=C(NNc1ccc(F)cc1)c1ccno1
InChIInChI=1S/C10H8FN3O2/c11-7-1-3-8(4-2-7)13-14-10(15)9-5-6-12-16-9/h1-6,13H,(H,14,15)
InChIKeyLTCXKWAFPFZHBU-UHFFFAOYSA-N
MW221.19 g/mol
LogP1.57
Rot. Bonds3

About N'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide

N'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide (PubChem CID 2812135) has the molecular formula C10H8FN3O2 and a molecular weight of 221.19 g/mol. Its IUPAC name is N'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide.

Molecular Properties

Compound NameN'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide
PubChem CID2812135
Molecular FormulaC10H8FN3O2
Molecular Weight221.19 g/mol
Exact Mass221.06
IUPAC NameN'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide
SMILESO=C(NNc1ccc(F)cc1)c1ccno1
InChIInChI=1S/C10H8FN3O2/c11-7-1-3-8(4-2-7)13-14-10(15)9-5-6-12-16-9/h1-6,13H,(H,14,15)
InChIKeyLTCXKWAFPFZHBU-UHFFFAOYSA-N
XLogP1.57
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.19
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide?
The IUPAC name of N'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide (CID 2812135) is N'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide.
What is the SMILES notation for N'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide?
The canonical SMILES for N'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide is O=C(NNc1ccc(F)cc1)c1ccno1.
What is the InChIKey of N'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide?
The InChIKey is LTCXKWAFPFZHBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FN3O2/c11-7-1-3-8(4-2-7)13-14-10(15)9-5-6-12-16-9/h1-6,13H,(H,14,15).
What are the key properties of N'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide?
N'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide has a molecular weight of 221.19 g/mol, XLogP of 1.57, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-fluorophenyl)-1,2-oxazole-5-carbohydrazide is sourced from PubChem (CID 2812135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).