2,3,4,5-tetrafluoro-6-hydrazinylaniline

C6H5F4N3 — CID 146620564

IUPAC2,3,4,5-tetrafluoro-6-hydrazinylaniline
SMILESNNc1c(N)c(F)c(F)c(F)c1F
InChIInChI=1S/C6H5F4N3/c7-1-2(8)4(10)6(13-12)5(11)3(1)9/h13H,11-12H2
InChIKeyOGBRPUQSFXCNOT-UHFFFAOYSA-N
MW195.12 g/mol
LogP1.11
Rot. Bonds1

About 2,3,4,5-tetrafluoro-6-hydrazinylaniline

2,3,4,5-tetrafluoro-6-hydrazinylaniline (PubChem CID 146620564) has the molecular formula C6H5F4N3 and a molecular weight of 195.12 g/mol. Its IUPAC name is 2,3,4,5-tetrafluoro-6-hydrazinylaniline.

Molecular Properties

Compound Name2,3,4,5-tetrafluoro-6-hydrazinylaniline
PubChem CID146620564
Molecular FormulaC6H5F4N3
Molecular Weight195.12 g/mol
Exact Mass195.04
IUPAC Name2,3,4,5-tetrafluoro-6-hydrazinylaniline
SMILESNNc1c(N)c(F)c(F)c(F)c1F
InChIInChI=1S/C6H5F4N3/c7-1-2(8)4(10)6(13-12)5(11)3(1)9/h13H,11-12H2
InChIKeyOGBRPUQSFXCNOT-UHFFFAOYSA-N
XLogP1.11
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.12
LogP ≤ 51.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3,4,5,6-tetrafluoro-2-N-methylbenzene-1,2-diamine
CID 146329780
azane;2,3,4,5,6-pentafluoroaniline
CID 172821602
2,3,4,5-tetrabromo-6-hydrazinylaniline
CID 144606422
CID 174020290
CID 174020290
3-amino-2,4,5,6-tetrafluorophenol
CID 12558020
dimethyl 3,4,6-trifluoro-5-hydrazinylbenzene-1,2-dicarboxylate
CID 45140711
2,3,5,6-tetrafluoro-N-(2,3,4,5,6-pentafluorophenyl)pyridin-4-amine
CID 13303728
2-chloro-4,5,6-trifluoro-3-propan-2-ylaniline
CID 156531002
2-amino-3,4,5,6-tetrafluorobenzoic acid
CID 139081576
6-chloro-4-N-(2,3,4,5,6-pentafluorophenyl)pyrimidine-4,5-diamine
CID 115564038
3-fluorobenzene-1,2,4-triamine
CID 89010456
(2,6-dibromo-4-fluorophenyl)hydrazine
CID 118447430

Frequently Asked Questions

What is the IUPAC name of 2,3,4,5-tetrafluoro-6-hydrazinylaniline?
The IUPAC name of 2,3,4,5-tetrafluoro-6-hydrazinylaniline (CID 146620564) is 2,3,4,5-tetrafluoro-6-hydrazinylaniline.
What is the SMILES notation for 2,3,4,5-tetrafluoro-6-hydrazinylaniline?
The canonical SMILES for 2,3,4,5-tetrafluoro-6-hydrazinylaniline is NNc1c(N)c(F)c(F)c(F)c1F.
What is the InChIKey of 2,3,4,5-tetrafluoro-6-hydrazinylaniline?
The InChIKey is OGBRPUQSFXCNOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5F4N3/c7-1-2(8)4(10)6(13-12)5(11)3(1)9/h13H,11-12H2.
What are the key properties of 2,3,4,5-tetrafluoro-6-hydrazinylaniline?
2,3,4,5-tetrafluoro-6-hydrazinylaniline has a molecular weight of 195.12 g/mol, XLogP of 1.11, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetrafluoro-6-hydrazinylaniline is sourced from PubChem (CID 146620564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).