N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide

C16H14F2N2O4 — CID 26893672

IUPACN'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)c2ccc(F)cc2F)cc1OC
InChIInChI=1S/C16H14F2N2O4/c1-23-13-6-3-9(7-14(13)24-2)15(21)19-20-16(22)11-5-4-10(17)8-12(11)18/h3-8H,1-2H3,(H,19,21)(H,20,22)
InChIKeyGXXXTGKZXNCOFP-UHFFFAOYSA-N
MW336.29 g/mol
LogP2.06
Rot. Bonds4

About N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide

N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide (PubChem CID 26893672) has the molecular formula C16H14F2N2O4 and a molecular weight of 336.29 g/mol. Its IUPAC name is N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide.

Molecular Properties

Compound NameN'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide
PubChem CID26893672
Molecular FormulaC16H14F2N2O4
Molecular Weight336.29 g/mol
Exact Mass336.09
IUPAC NameN'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)c2ccc(F)cc2F)cc1OC
InChIInChI=1S/C16H14F2N2O4/c1-23-13-6-3-9(7-14(13)24-2)15(21)19-20-16(22)11-5-4-10(17)8-12(11)18/h3-8H,1-2H3,(H,19,21)(H,20,22)
InChIKeyGXXXTGKZXNCOFP-UHFFFAOYSA-N
XLogP2.06
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.29
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-(2,4-difluorobenzoyl)-3-methoxy-4-propoxybenzohydrazide
CID 9440206
N'-(3,5-difluorobenzoyl)-3,4-dimethoxybenzohydrazide
CID 24645355
N-(2,4-difluorophenyl)-3,4-dimethoxybenzamide
CID 966752
N'-(2-bromo-4-fluorobenzoyl)-4-ethoxy-3-methoxybenzohydrazide
CID 9151469
N'-(5-bromo-2-methoxybenzoyl)-3,4-dimethoxybenzohydrazide
CID 17094413
N'-(2-chloro-4-fluorobenzoyl)-3-methoxy-4-propoxybenzohydrazide
CID 26621941
N'-(4-ethoxybenzoyl)-2,4-difluorobenzohydrazide
CID 8915144
2-[4-[[(2-fluorobenzoyl)amino]carbamoyl]-2-methoxyphenoxy]acetamide
CID 9084762
N'-(4-chlorobenzoyl)-2,4-difluorobenzohydrazide
CID 8961402
N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide
CID 1210380
N'-(4-chloro-2-iodobenzoyl)-3,4-dimethoxybenzohydrazide
CID 39714334
N-[[(3,4-dimethoxybenzoyl)amino]carbamothioyl]-2-fluorobenzamide
CID 4950541

Frequently Asked Questions

What is the IUPAC name of N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide?
The IUPAC name of N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide (CID 26893672) is N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide.
What is the SMILES notation for N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide?
The canonical SMILES for N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide is COc1ccc(C(=O)NNC(=O)c2ccc(F)cc2F)cc1OC.
What is the InChIKey of N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide?
The InChIKey is GXXXTGKZXNCOFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F2N2O4/c1-23-13-6-3-9(7-14(13)24-2)15(21)19-20-16(22)11-5-4-10(17)8-12(11)18/h3-8H,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide?
N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide has a molecular weight of 336.29 g/mol, XLogP of 2.06, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide is sourced from PubChem (CID 26893672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).