2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide

C15H12F2N2O3 — CID 2709557

IUPAC2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide
SMILESO=C(COc1cccc(F)c1)NNC(=O)c1ccccc1F
InChIInChI=1S/C15H12F2N2O3/c16-10-4-3-5-11(8-10)22-9-14(20)18-19-15(21)12-6-1-2-7-13(12)17/h1-8H,9H2,(H,18,20)(H,19,21)
InChIKeyXSUNNCOJMPSJPG-UHFFFAOYSA-N
MW306.27 g/mol
LogP1.80
Rot. Bonds4

About 2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide

2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide (PubChem CID 2709557) has the molecular formula C15H12F2N2O3 and a molecular weight of 306.27 g/mol. Its IUPAC name is 2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide.

Molecular Properties

Compound Name2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide
PubChem CID2709557
Molecular FormulaC15H12F2N2O3
Molecular Weight306.27 g/mol
Exact Mass306.08
IUPAC Name2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide
SMILESO=C(COc1cccc(F)c1)NNC(=O)c1ccccc1F
InChIInChI=1S/C15H12F2N2O3/c16-10-4-3-5-11(8-10)22-9-14(20)18-19-15(21)12-6-1-2-7-13(12)17/h1-8H,9H2,(H,18,20)(H,19,21)
InChIKeyXSUNNCOJMPSJPG-UHFFFAOYSA-N
XLogP1.80
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.27
LogP ≤ 51.80
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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Related Compounds

N'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide
CID 2670466
2-fluoro-N'-[2-(4-iodophenoxy)acetyl]benzohydrazide
CID 55332310
1-[[2-(3-fluorophenoxy)acetyl]amino]-3-(2-fluorophenyl)thiourea
CID 9468538
2-fluoro-N-[2-oxo-2-[2-[2-[3-(trifluoromethyl)phenoxy]acetyl]hydrazinyl]ethyl]benzamide
CID 18228275
2-fluoro-N-[2-[2-[2-(4-fluorophenoxy)acetyl]hydrazinyl]-2-oxoethyl]benzamide
CID 24634581
[2-[2-(2-fluorobenzoyl)hydrazinyl]-2-oxoethyl] 2,6-difluorobenzoate
CID 7725646
2-(3-fluorophenoxy)-N-phenylacetamide
CID 2709732
4-chloro-3-[[[2-(3-fluorophenoxy)acetyl]amino]carbamoyl]-N,N-dimethylbenzenesulfonamide
CID 3971175
2-chloro-4-fluoro-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 51146468
2-[[2-(3-fluorophenoxy)acetyl]amino]-N-prop-2-enylbenzamide
CID 18158401
N'-[2-(3-fluorophenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide
CID 2670452
2-(3-fluorophenoxy)-N-propan-2-ylacetamide
CID 60626005

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide?
The IUPAC name of 2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide (CID 2709557) is 2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide.
What is the SMILES notation for 2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide?
The canonical SMILES for 2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide is O=C(COc1cccc(F)c1)NNC(=O)c1ccccc1F.
What is the InChIKey of 2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide?
The InChIKey is XSUNNCOJMPSJPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F2N2O3/c16-10-4-3-5-11(8-10)22-9-14(20)18-19-15(21)12-6-1-2-7-13(12)17/h1-8H,9H2,(H,18,20)(H,19,21).
What are the key properties of 2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide?
2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide has a molecular weight of 306.27 g/mol, XLogP of 1.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide is sourced from PubChem (CID 2709557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).