2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide

C23H19FN2O5 — CID 2546824

IUPAC2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide
SMILESO=C(COc1ccc(C(=O)c2ccccc2)cc1)NNC(=O)COc1ccccc1F
InChIInChI=1S/C23H19FN2O5/c24-19-8-4-5-9-20(19)31-15-22(28)26-25-21(27)14-30-18-12-10-17(11-13-18)23(29)16-6-2-1-3-7-16/h1-13H,14-15H2,(H,25,27)(H,26,28)
InChIKeyAHFZJWPMCNJLCG-UHFFFAOYSA-N
MW422.41 g/mol
LogP2.66
Rot. Bonds8

About 2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide

2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide (PubChem CID 2546824) has the molecular formula C23H19FN2O5 and a molecular weight of 422.41 g/mol. Its IUPAC name is 2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide.

Molecular Properties

Compound Name2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide
PubChem CID2546824
Molecular FormulaC23H19FN2O5
Molecular Weight422.41 g/mol
Exact Mass422.13
IUPAC Name2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide
SMILESO=C(COc1ccc(C(=O)c2ccccc2)cc1)NNC(=O)COc1ccccc1F
InChIInChI=1S/C23H19FN2O5/c24-19-8-4-5-9-20(19)31-15-22(28)26-25-21(27)14-30-18-12-10-17(11-13-18)23(29)16-6-2-1-3-7-16/h1-13H,14-15H2,(H,25,27)(H,26,28)
InChIKeyAHFZJWPMCNJLCG-UHFFFAOYSA-N
XLogP2.66
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.41
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(4-benzoylphenoxy)-1-(2-fluorophenyl)ethanone
CID 7717893
N'-[2-(2-fluorophenoxy)acetyl]-4-(4-fluorophenyl)-4-oxobutanehydrazide
CID 9471970
N'-[2-(4-bromophenoxy)acetyl]-3-(2-fluorophenoxy)propanehydrazide
CID 78775232
N'-[2-(2-fluorophenoxy)acetyl]-4-(trifluoromethyl)benzohydrazide
CID 7601146
N'-[2-(2-chlorophenoxy)acetyl]-2-(4-fluorophenoxy)acetohydrazide
CID 2561230
2-(2-fluorophenoxy)-N'-(2-methylsulfanylacetyl)acetohydrazide
CID 9471875
N'-[2-(2-fluorophenoxy)acetyl]pyridine-4-carbohydrazide
CID 17439720
N'-[2-(2-fluorophenoxy)acetyl]-1,3-benzothiazole-6-carbohydrazide
CID 7809035
2-[4-(4-fluorobenzoyl)phenoxy]-1-(2-fluorophenyl)ethanone
CID 2086964
2-(4-benzoylphenoxy)-N-[(2-methylpropan-2-yl)oxy]acetamide
CID 75435846
N-(benzylcarbamoyl)-2-[4-(4-fluorobenzoyl)phenoxy]acetamide
CID 7795142
2-(4-chlorophenoxy)-N'-[2-(2-chlorophenoxy)acetyl]acetohydrazide
CID 3372388

Frequently Asked Questions

What is the IUPAC name of 2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide?
The IUPAC name of 2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide (CID 2546824) is 2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide.
What is the SMILES notation for 2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide?
The canonical SMILES for 2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide is O=C(COc1ccc(C(=O)c2ccccc2)cc1)NNC(=O)COc1ccccc1F.
What is the InChIKey of 2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide?
The InChIKey is AHFZJWPMCNJLCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19FN2O5/c24-19-8-4-5-9-20(19)31-15-22(28)26-25-21(27)14-30-18-12-10-17(11-13-18)23(29)16-6-2-1-3-7-16/h1-13H,14-15H2,(H,25,27)(H,26,28).
What are the key properties of 2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide?
2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide has a molecular weight of 422.41 g/mol, XLogP of 2.66, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzoylphenoxy)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide is sourced from PubChem (CID 2546824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).