[2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine

C13H20F3N3 — CID 114247323

IUPAC[2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine
SMILESCCCCC(C)C(NN)c1cnccc1C(F)(F)F
InChIInChI=1S/C13H20F3N3/c1-3-4-5-9(2)12(19-17)10-8-18-7-6-11(10)13(14,15)16/h6-9,12,19H,3-5,17H2,1-2H3
InChIKeyCFXVFKWPONGZEC-UHFFFAOYSA-N
MW275.32 g/mol
LogP3.43
Rot. Bonds6

About [2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine

[2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine (PubChem CID 114247323) has the molecular formula C13H20F3N3 and a molecular weight of 275.32 g/mol. Its IUPAC name is [2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine.

Molecular Properties

Compound Name[2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine
PubChem CID114247323
Molecular FormulaC13H20F3N3
Molecular Weight275.32 g/mol
Exact Mass275.16
IUPAC Name[2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine
SMILESCCCCC(C)C(NN)c1cnccc1C(F)(F)F
InChIInChI=1S/C13H20F3N3/c1-3-4-5-9(2)12(19-17)10-8-18-7-6-11(10)13(14,15)16/h6-9,12,19H,3-5,17H2,1-2H3
InChIKeyCFXVFKWPONGZEC-UHFFFAOYSA-N
XLogP3.43
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.32
LogP ≤ 53.43
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

[2-ethoxy-1-[4-(trifluoromethyl)-3-pyridinyl]propyl]hydrazine
CID 102710327
1-[4-(trifluoromethyl)-3-pyridinyl]nonylhydrazine
CID 102710491
[2-ethoxy-3-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]butyl]hydrazine
CID 102710430
[2-methyl-1-[2-(trifluoromethyl)phenyl]pentyl]hydrazine
CID 105304834
1-[4-(trifluoromethyl)-3-pyridinyl]nonan-1-ol
CID 102710219
1-[4-(trifluoromethyl)-3-pyridinyl]heptan-1-ol
CID 102707324
N-ethyl-2-methoxy-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine
CID 102708349
N,2-dimethyl-3-methylsulfanyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine
CID 114222081
N-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]butan-1-amine
CID 102708033
[4-methoxy-1-[4-(trifluoromethyl)-3-pyridinyl]butyl]hydrazine
CID 102710333
[2-methylsulfanyl-1-[4-(trifluoromethyl)-3-pyridinyl]ethyl]hydrazine
CID 102710309
[3-methylsulfanyl-1-[4-(trifluoromethyl)-3-pyridinyl]propyl]hydrazine
CID 102710527

Frequently Asked Questions

What is the IUPAC name of [2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine?
The IUPAC name of [2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine (CID 114247323) is [2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine.
What is the SMILES notation for [2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine?
The canonical SMILES for [2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine is CCCCC(C)C(NN)c1cnccc1C(F)(F)F.
What is the InChIKey of [2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine?
The InChIKey is CFXVFKWPONGZEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20F3N3/c1-3-4-5-9(2)12(19-17)10-8-18-7-6-11(10)13(14,15)16/h6-9,12,19H,3-5,17H2,1-2H3.
What are the key properties of [2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine?
[2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine has a molecular weight of 275.32 g/mol, XLogP of 3.43, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-1-[4-(trifluoromethyl)-3-pyridinyl]hexyl]hydrazine is sourced from PubChem (CID 114247323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).