N'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide

C16H14F2N2O3 — CID 2670466

IUPACN'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide
SMILESO=C(COc1cccc(F)c1)NNC(=O)Cc1ccccc1F
InChIInChI=1S/C16H14F2N2O3/c17-12-5-3-6-13(9-12)23-10-16(22)20-19-15(21)8-11-4-1-2-7-14(11)18/h1-7,9H,8,10H2,(H,19,21)(H,20,22)
InChIKeyVYEPUQRSNPZVLG-UHFFFAOYSA-N
MW320.30 g/mol
LogP1.73
Rot. Bonds5

About N'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide

N'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide (PubChem CID 2670466) has the molecular formula C16H14F2N2O3 and a molecular weight of 320.30 g/mol. Its IUPAC name is N'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide.

Molecular Properties

Compound NameN'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide
PubChem CID2670466
Molecular FormulaC16H14F2N2O3
Molecular Weight320.30 g/mol
Exact Mass320.10
IUPAC NameN'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide
SMILESO=C(COc1cccc(F)c1)NNC(=O)Cc1ccccc1F
InChIInChI=1S/C16H14F2N2O3/c17-12-5-3-6-13(9-12)23-10-16(22)20-19-15(21)8-11-4-1-2-7-14(11)18/h1-7,9H,8,10H2,(H,19,21)(H,20,22)
InChIKeyVYEPUQRSNPZVLG-UHFFFAOYSA-N
XLogP1.73
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.30
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide?
The IUPAC name of N'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide (CID 2670466) is N'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide.
What is the SMILES notation for N'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide?
The canonical SMILES for N'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide is O=C(COc1cccc(F)c1)NNC(=O)Cc1ccccc1F.
What is the InChIKey of N'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide?
The InChIKey is VYEPUQRSNPZVLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F2N2O3/c17-12-5-3-6-13(9-12)23-10-16(22)20-19-15(21)8-11-4-1-2-7-14(11)18/h1-7,9H,8,10H2,(H,19,21)(H,20,22).
What are the key properties of N'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide?
N'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide has a molecular weight of 320.30 g/mol, XLogP of 1.73, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide is sourced from PubChem (CID 2670466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).