3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide

C14H14F2N4O — CID 63186092

IUPAC3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide
SMILESNNc1c(F)cc(C(=O)NCCc2ccncc2)cc1F
InChIInChI=1S/C14H14F2N4O/c15-11-7-10(8-12(16)13(11)20-17)14(21)19-6-3-9-1-4-18-5-2-9/h1-2,4-5,7-8,20H,3,6,17H2,(H,19,21)
InChIKeyJIEYLCWLRHXKIA-UHFFFAOYSA-N
MW292.29 g/mol
LogP1.62
Rot. Bonds5

About 3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide

3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide (PubChem CID 63186092) has the molecular formula C14H14F2N4O and a molecular weight of 292.29 g/mol. Its IUPAC name is 3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide.

Molecular Properties

Compound Name3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide
PubChem CID63186092
Molecular FormulaC14H14F2N4O
Molecular Weight292.29 g/mol
Exact Mass292.11
IUPAC Name3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide
SMILESNNc1c(F)cc(C(=O)NCCc2ccncc2)cc1F
InChIInChI=1S/C14H14F2N4O/c15-11-7-10(8-12(16)13(11)20-17)14(21)19-6-3-9-1-4-18-5-2-9/h1-2,4-5,7-8,20H,3,6,17H2,(H,19,21)
InChIKeyJIEYLCWLRHXKIA-UHFFFAOYSA-N
XLogP1.62
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.29
LogP ≤ 51.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

3,5-difluoro-4-(methylamino)-N-(2-pyridin-4-ylethyl)benzamide
CID 63185327
4-amino-3-fluoro-N-(2-pyridin-4-ylethyl)benzamide
CID 62680036
3,5-diamino-N-(2-pyridin-4-ylethyl)benzamide
CID 61104259
4-amino-3,5-difluoro-N-(2-pyridin-3-ylethyl)benzamide
CID 63185192
2-fluoro-N-(2-pyridin-4-ylethyl)benzamide
CID 935612
3,5-difluoro-4-hydrazinyl-N-[(4-methyl-3-pyridinyl)methyl]benzamide
CID 114957550
4-ethyl-N-(2-pyridin-4-ylethyl)benzamide
CID 70990816
3,5-difluoro-4-hydrazinyl-N-[2-(methylsulfamoyl)ethyl]benzamide
CID 106340860
3-fluoro-2-(methylamino)-N-(2-pyridin-4-ylethyl)benzamide
CID 62661709
4-(3-hydroxy-3-methylbutyl)-N-(2-pyridin-4-ylethyl)benzamide
CID 56910378
N-[2-(4-ethylphenyl)ethyl]pyridine-4-carboxamide
CID 110787242
5-(2-pyridin-4-ylethylcarbamoyl)furan-3-carboxylic acid
CID 104607208

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide?
The IUPAC name of 3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide (CID 63186092) is 3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide.
What is the SMILES notation for 3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide?
The canonical SMILES for 3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide is NNc1c(F)cc(C(=O)NCCc2ccncc2)cc1F.
What is the InChIKey of 3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide?
The InChIKey is JIEYLCWLRHXKIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N4O/c15-11-7-10(8-12(16)13(11)20-17)14(21)19-6-3-9-1-4-18-5-2-9/h1-2,4-5,7-8,20H,3,6,17H2,(H,19,21).
What are the key properties of 3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide?
3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide has a molecular weight of 292.29 g/mol, XLogP of 1.62, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-4-hydrazinyl-N-(2-pyridin-4-ylethyl)benzamide is sourced from PubChem (CID 63186092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).