[1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine

C11H16F3N3 — CID 105262044

IUPAC[1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine
SMILESCCc1cnccc1C(CCC(F)(F)F)NN
InChIInChI=1S/C11H16F3N3/c1-2-8-7-16-6-4-9(8)10(17-15)3-5-11(12,13)14/h4,6-7,10,17H,2-3,5,15H2,1H3
InChIKeyBXSFWLLGKJFRDD-UHFFFAOYSA-N
MW247.26 g/mol
LogP2.49
Rot. Bonds5

About [1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine

[1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine (PubChem CID 105262044) has the molecular formula C11H16F3N3 and a molecular weight of 247.26 g/mol. Its IUPAC name is [1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine.

Molecular Properties

Compound Name[1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine
PubChem CID105262044
Molecular FormulaC11H16F3N3
Molecular Weight247.26 g/mol
Exact Mass247.13
IUPAC Name[1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine
SMILESCCc1cnccc1C(CCC(F)(F)F)NN
InChIInChI=1S/C11H16F3N3/c1-2-8-7-16-6-4-9(8)10(17-15)3-5-11(12,13)14/h4,6-7,10,17H,2-3,5,15H2,1H3
InChIKeyBXSFWLLGKJFRDD-UHFFFAOYSA-N
XLogP2.49
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.26
LogP ≤ 52.49
H-Bond Donors ≤ 52
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

[1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine
CID 105262232
[1-(3-ethyl-4-pyridinyl)-2-methoxyethyl]hydrazine
CID 105262260
[1-(3-ethyl-4-pyridinyl)-2-propoxyethyl]hydrazine
CID 105262063
[1-(3-ethyl-4-pyridinyl)-2-(1,3-thiazol-5-yl)ethyl]hydrazine
CID 105262110
1-(3-ethyl-4-pyridinyl)prop-2-ynylhydrazine
CID 105262150
1-(3-methyl-4-pyridinyl)pentylhydrazine
CID 105261719
[2-(1,3-diethylpyrazol-5-yl)-1-(3-ethyl-4-pyridinyl)ethyl]hydrazine
CID 105262256
[(2,6-difluorophenyl)-(3-ethyl-4-pyridinyl)methyl]hydrazine
CID 105262104
[2-(2-bicyclo[2.2.1]heptanyl)-1-(3-ethyl-4-pyridinyl)ethyl]hydrazine
CID 105262326
[3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine
CID 105206013
3-(5,5,5-trifluoro-2-hydrazinylpentyl)pyridin-4-amine
CID 105249119
1-[4-(trifluoromethyl)-3-pyridinyl]nonylhydrazine
CID 102710491

Frequently Asked Questions

What is the IUPAC name of [1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine?
The IUPAC name of [1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine (CID 105262044) is [1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine.
What is the SMILES notation for [1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine?
The canonical SMILES for [1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine is CCc1cnccc1C(CCC(F)(F)F)NN.
What is the InChIKey of [1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine?
The InChIKey is BXSFWLLGKJFRDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16F3N3/c1-2-8-7-16-6-4-9(8)10(17-15)3-5-11(12,13)14/h4,6-7,10,17H,2-3,5,15H2,1H3.
What are the key properties of [1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine?
[1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine has a molecular weight of 247.26 g/mol, XLogP of 2.49, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-ethyl-4-pyridinyl)-4,4,4-trifluorobutyl]hydrazine is sourced from PubChem (CID 105262044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).