3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide

C13H10F3N3O — CID 63186687

IUPAC3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide
SMILESNNc1c(F)cc(C(=O)Nc2cccc(F)c2)cc1F
InChIInChI=1S/C13H10F3N3O/c14-8-2-1-3-9(6-8)18-13(20)7-4-10(15)12(19-17)11(16)5-7/h1-6,19H,17H2,(H,18,20)
InChIKeyQPATUMLYXHGNCN-UHFFFAOYSA-N
MW281.24 g/mol
LogP2.64
Rot. Bonds3

About 3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide

3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide (PubChem CID 63186687) has the molecular formula C13H10F3N3O and a molecular weight of 281.24 g/mol. Its IUPAC name is 3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide.

Molecular Properties

Compound Name3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide
PubChem CID63186687
Molecular FormulaC13H10F3N3O
Molecular Weight281.24 g/mol
Exact Mass281.08
IUPAC Name3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide
SMILESNNc1c(F)cc(C(=O)Nc2cccc(F)c2)cc1F
InChIInChI=1S/C13H10F3N3O/c14-8-2-1-3-9(6-8)18-13(20)7-4-10(15)12(19-17)11(16)5-7/h1-6,19H,17H2,(H,18,20)
InChIKeyQPATUMLYXHGNCN-UHFFFAOYSA-N
XLogP2.64
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.24
LogP ≤ 52.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-bromophenyl)-3,5-difluoro-4-hydrazinylbenzamide
CID 63186774
3,5-difluoro-4-hydrazinyl-N-(3-methylsulfanylphenyl)benzamide
CID 63186134
3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide
CID 55158095
N-(2,6-dichlorophenyl)-3,5-difluoro-4-hydrazinylbenzamide
CID 65499076
N-(4-bromo-3-methylphenyl)-3,5-difluoro-4-hydrazinylbenzamide
CID 63185694
N-(3-chloro-4-methylphenyl)-3,5-difluoro-4-hydrazinylbenzamide
CID 63186135
3-acetamido-N-(3-fluorophenyl)benzamide
CID 2443243
3-bromo-4-fluoro-N-(3-fluorophenyl)benzamide
CID 103706269
4-N-(2-fluorophenyl)-1-N-(3-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049881
N-(3-fluorophenyl)-4-(methylamino)benzamide
CID 62166900
2,3,5,6-tetrafluoro-1-N,4-N-bis(3-fluorophenyl)benzene-1,4-dicarboxamide
CID 3094065
3-N-(2,4-difluorophenyl)-1-N-(3-fluorophenyl)benzene-1,3-dicarboxamide
CID 109057757

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide?
The IUPAC name of 3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide (CID 63186687) is 3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide.
What is the SMILES notation for 3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide?
The canonical SMILES for 3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide is NNc1c(F)cc(C(=O)Nc2cccc(F)c2)cc1F.
What is the InChIKey of 3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide?
The InChIKey is QPATUMLYXHGNCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3N3O/c14-8-2-1-3-9(6-8)18-13(20)7-4-10(15)12(19-17)11(16)5-7/h1-6,19H,17H2,(H,18,20).
What are the key properties of 3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide?
3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide has a molecular weight of 281.24 g/mol, XLogP of 2.64, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide is sourced from PubChem (CID 63186687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).