N'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide

C16H14F2N2O3 — CID 8915144

IUPACN'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide
SMILESCCOc1ccc(C(=O)NNC(=O)c2ccc(F)cc2F)cc1
InChIInChI=1S/C16H14F2N2O3/c1-2-23-12-6-3-10(4-7-12)15(21)19-20-16(22)13-8-5-11(17)9-14(13)18/h3-9H,2H2,1H3,(H,19,21)(H,20,22)
InChIKeyMAOKQOFOXWKULR-UHFFFAOYSA-N
MW320.30 g/mol
LogP2.44
Rot. Bonds4

About N'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide

N'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide (PubChem CID 8915144) has the molecular formula C16H14F2N2O3 and a molecular weight of 320.30 g/mol. Its IUPAC name is N'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide.

Molecular Properties

Compound NameN'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide
PubChem CID8915144
Molecular FormulaC16H14F2N2O3
Molecular Weight320.30 g/mol
Exact Mass320.10
IUPAC NameN'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide
SMILESCCOc1ccc(C(=O)NNC(=O)c2ccc(F)cc2F)cc1
InChIInChI=1S/C16H14F2N2O3/c1-2-23-12-6-3-10(4-7-12)15(21)19-20-16(22)13-8-5-11(17)9-14(13)18/h3-9H,2H2,1H3,(H,19,21)(H,20,22)
InChIKeyMAOKQOFOXWKULR-UHFFFAOYSA-N
XLogP2.44
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.30
LogP ≤ 52.44
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'-(4-ethoxybenzoyl)-2,5-difluorobenzohydrazide
CID 30485626
5-chloro-N'-(4-ethoxybenzoyl)-2-fluorobenzohydrazide
CID 9086466
5-bromo-N'-(4-ethoxybenzoyl)-2-fluorobenzohydrazide
CID 9492712
N'-(4-chlorobenzoyl)-2,4-difluorobenzohydrazide
CID 8961402
N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide
CID 7600016
N-[2-[[2-(4-ethoxyphenyl)acetyl]amino]ethyl]-2,4-difluorobenzamide
CID 108573126
N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide
CID 26893672
N-[2-(4-ethoxyanilino)-2-oxoethyl]-2,4-difluorobenzamide
CID 29415155
N'-(2,4-difluorobenzoyl)-3-methoxy-4-propoxybenzohydrazide
CID 9440206
N'-(4-ethoxybenzoyl)-5-fluoro-1H-indole-2-carbohydrazide
CID 134034269
N'-(4-butoxybenzoyl)-4-ethoxybenzohydrazide
CID 7979581
2,5-dichloro-N'-(4-ethoxybenzoyl)thiophene-3-carbohydrazide
CID 26767393

Frequently Asked Questions

What is the IUPAC name of N'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide?
The IUPAC name of N'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide (CID 8915144) is N'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide.
What is the SMILES notation for N'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide?
The canonical SMILES for N'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide is CCOc1ccc(C(=O)NNC(=O)c2ccc(F)cc2F)cc1.
What is the InChIKey of N'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide?
The InChIKey is MAOKQOFOXWKULR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F2N2O3/c1-2-23-12-6-3-10(4-7-12)15(21)19-20-16(22)13-8-5-11(17)9-14(13)18/h3-9H,2H2,1H3,(H,19,21)(H,20,22).
What are the key properties of N'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide?
N'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide has a molecular weight of 320.30 g/mol, XLogP of 2.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide is sourced from PubChem (CID 8915144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).