[6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine

C10H10F3N3O — CID 106795721

IUPAC[6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine
SMILESC#CC(C)Oc1cc(C(F)(F)F)cc(NN)n1
InChIInChI=1S/C10H10F3N3O/c1-3-6(2)17-9-5-7(10(11,12)13)4-8(15-9)16-14/h1,4-6H,14H2,2H3,(H,15,16)
InChIKeyQNWHYVMJXXOYFP-UHFFFAOYSA-N
MW245.20 g/mol
LogP1.79
Rot. Bonds3

About [6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine

[6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine (PubChem CID 106795721) has the molecular formula C10H10F3N3O and a molecular weight of 245.20 g/mol. Its IUPAC name is [6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine
PubChem CID106795721
Molecular FormulaC10H10F3N3O
Molecular Weight245.20 g/mol
Exact Mass245.08
IUPAC Name[6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine
SMILESC#CC(C)Oc1cc(C(F)(F)F)cc(NN)n1
InChIInChI=1S/C10H10F3N3O/c1-3-6(2)17-9-5-7(10(11,12)13)4-8(15-9)16-14/h1,4-6H,14H2,2H3,(H,15,16)
InChIKeyQNWHYVMJXXOYFP-UHFFFAOYSA-N
XLogP1.79
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.20
LogP ≤ 51.79
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

[6-(3-methylbutoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 102721220
(6-but-3-yn-2-yloxy-2-phenylpyrimidin-4-yl)hydrazine
CID 106795688
[6-(4-methylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 102721247
[6-(2-methylsulfanylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 102721306
[6-(4-fluorophenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 102721265
[6-(2,5-dimethylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 102721260
[6-(3-methylphenoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 102721263
6-(3-methylbutan-2-yloxy)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720055
6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102719982
[6-(2-cyclopropylethoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 106207896
6-hydrazinyl-N-(5-methylhexan-2-yl)-4-(trifluoromethyl)pyridin-2-amine
CID 102720760
N-(2,3-dimethylbutyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720794

Frequently Asked Questions

What is the IUPAC name of [6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine?
The IUPAC name of [6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine (CID 106795721) is [6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine.
What is the SMILES notation for [6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine?
The canonical SMILES for [6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine is C#CC(C)Oc1cc(C(F)(F)F)cc(NN)n1.
What is the InChIKey of [6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine?
The InChIKey is QNWHYVMJXXOYFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3N3O/c1-3-6(2)17-9-5-7(10(11,12)13)4-8(15-9)16-14/h1,4-6H,14H2,2H3,(H,15,16).
What are the key properties of [6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine?
[6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine has a molecular weight of 245.20 g/mol, XLogP of 1.79, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-but-3-yn-2-yloxy-4-(trifluoromethyl)-2-pyridinyl]hydrazine is sourced from PubChem (CID 106795721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).