N-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine

C13H13F3N4 — CID 114073139

IUPACN-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine
SMILESCCN(c1ccc(F)cc1)c1nc(NN)c(F)cc1F
InChIInChI=1S/C13H13F3N4/c1-2-20(9-5-3-8(14)4-6-9)13-11(16)7-10(15)12(18-13)19-17/h3-7H,2,17H2,1H3,(H,18,19)
InChIKeyABUZCOPVEDYLEY-UHFFFAOYSA-N
MW282.27 g/mol
LogP2.94
Rot. Bonds4

About N-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine

N-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine (PubChem CID 114073139) has the molecular formula C13H13F3N4 and a molecular weight of 282.27 g/mol. Its IUPAC name is N-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine
PubChem CID114073139
Molecular FormulaC13H13F3N4
Molecular Weight282.27 g/mol
Exact Mass282.11
IUPAC NameN-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine
SMILESCCN(c1ccc(F)cc1)c1nc(NN)c(F)cc1F
InChIInChI=1S/C13H13F3N4/c1-2-20(9-5-3-8(14)4-6-9)13-11(16)7-10(15)12(18-13)19-17/h3-7H,2,17H2,1H3,(H,18,19)
InChIKeyABUZCOPVEDYLEY-UHFFFAOYSA-N
XLogP2.94
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.27
LogP ≤ 52.94
H-Bond Donors ≤ 52
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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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine?
The IUPAC name of N-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine (CID 114073139) is N-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine.
What is the SMILES notation for N-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine?
The canonical SMILES for N-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine is CCN(c1ccc(F)cc1)c1nc(NN)c(F)cc1F.
What is the InChIKey of N-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine?
The InChIKey is ABUZCOPVEDYLEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13F3N4/c1-2-20(9-5-3-8(14)4-6-9)13-11(16)7-10(15)12(18-13)19-17/h3-7H,2,17H2,1H3,(H,18,19).
What are the key properties of N-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine?
N-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine has a molecular weight of 282.27 g/mol, XLogP of 2.94, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3,5-difluoro-N-(4-fluorophenyl)-6-hydrazinylpyridin-2-amine is sourced from PubChem (CID 114073139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).