2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide

C21H16ClFN2O3 — CID 26901785

IUPAC2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide
SMILESO=C(NNC(=O)c1ccccc1OCc1ccccc1Cl)c1ccccc1F
InChIInChI=1S/C21H16ClFN2O3/c22-17-10-4-1-7-14(17)13-28-19-12-6-3-9-16(19)21(27)25-24-20(26)15-8-2-5-11-18(15)23/h1-12H,13H2,(H,24,26)(H,25,27)
InChIKeyIZHKURRRDJWICJ-UHFFFAOYSA-N
MW398.82 g/mol
LogP4.13
Rot. Bonds5

About 2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide

2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide (PubChem CID 26901785) has the molecular formula C21H16ClFN2O3 and a molecular weight of 398.82 g/mol. Its IUPAC name is 2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide.

Molecular Properties

Compound Name2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide
PubChem CID26901785
Molecular FormulaC21H16ClFN2O3
Molecular Weight398.82 g/mol
Exact Mass398.08
IUPAC Name2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide
SMILESO=C(NNC(=O)c1ccccc1OCc1ccccc1Cl)c1ccccc1F
InChIInChI=1S/C21H16ClFN2O3/c22-17-10-4-1-7-14(17)13-28-19-12-6-3-9-16(19)21(27)25-24-20(26)15-8-2-5-11-18(15)23/h1-12H,13H2,(H,24,26)(H,25,27)
InChIKeyIZHKURRRDJWICJ-UHFFFAOYSA-N
XLogP4.13
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.82
LogP ≤ 54.13
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

2-[(2-chlorophenyl)methoxy]-N'-(2,3,4,5,6-pentafluorophenyl)benzohydrazide
CID 26886312
2-[(4-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide
CID 9402900
[2-(2-benzoylhydrazinyl)-2-oxoethyl] 2-[(2-chlorophenyl)methoxy]benzoate
CID 2594288
N'-[2-[(2-chlorophenyl)methoxy]benzoyl]-1H-indazole-3-carbohydrazide
CID 27568166
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CID 27568145
1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one
CID 29287743
2-[(2-chlorophenyl)methoxy]-N-(fluoren-9-ylideneamino)benzamide
CID 2367127
(2-methoxyphenyl) 2-[(2-chlorophenyl)methoxy]benzoate
CID 2392110
2-[(2-fluorophenyl)methoxy]benzoic acid
CID 8707038
2-[(2-chlorophenyl)methoxy]-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide
CID 135833052
N-(3-amino-2-methylpropyl)-2-[(2-chlorophenyl)methoxy]benzamide;hydrochloride
CID 119997645
2-[(2-chlorophenoxy)methyl]benzohydrazide
CID 63576691

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide?
The IUPAC name of 2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide (CID 26901785) is 2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide.
What is the SMILES notation for 2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide?
The canonical SMILES for 2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide is O=C(NNC(=O)c1ccccc1OCc1ccccc1Cl)c1ccccc1F.
What is the InChIKey of 2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide?
The InChIKey is IZHKURRRDJWICJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16ClFN2O3/c22-17-10-4-1-7-14(17)13-28-19-12-6-3-9-16(19)21(27)25-24-20(26)15-8-2-5-11-18(15)23/h1-12H,13H2,(H,24,26)(H,25,27).
What are the key properties of 2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide?
2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide has a molecular weight of 398.82 g/mol, XLogP of 4.13, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide is sourced from PubChem (CID 26901785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).