1-[4-(trifluoromethyl)phenyl]propylhydrazine

C10H13F3N2 — CID 70339292

IUPAC1-[4-(trifluoromethyl)phenyl]propylhydrazine
SMILESCCC(NN)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C10H13F3N2/c1-2-9(15-14)7-3-5-8(6-4-7)10(11,12)13/h3-6,9,15H,2,14H2,1H3
InChIKeyVGAXHPZOILZPNF-UHFFFAOYSA-N
MW218.22 g/mol
LogP2.62
Rot. Bonds3

About 1-[4-(trifluoromethyl)phenyl]propylhydrazine

1-[4-(trifluoromethyl)phenyl]propylhydrazine (PubChem CID 70339292) has the molecular formula C10H13F3N2 and a molecular weight of 218.22 g/mol. Its IUPAC name is 1-[4-(trifluoromethyl)phenyl]propylhydrazine.

Molecular Properties

Compound Name1-[4-(trifluoromethyl)phenyl]propylhydrazine
PubChem CID70339292
Molecular FormulaC10H13F3N2
Molecular Weight218.22 g/mol
Exact Mass218.10
IUPAC Name1-[4-(trifluoromethyl)phenyl]propylhydrazine
SMILESCCC(NN)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C10H13F3N2/c1-2-9(15-14)7-3-5-8(6-4-7)10(11,12)13/h3-6,9,15H,2,14H2,1H3
InChIKeyVGAXHPZOILZPNF-UHFFFAOYSA-N
XLogP2.62
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 1-[4-(trifluoromethyl)phenyl]propylhydrazine?
The IUPAC name of 1-[4-(trifluoromethyl)phenyl]propylhydrazine (CID 70339292) is 1-[4-(trifluoromethyl)phenyl]propylhydrazine.
What is the SMILES notation for 1-[4-(trifluoromethyl)phenyl]propylhydrazine?
The canonical SMILES for 1-[4-(trifluoromethyl)phenyl]propylhydrazine is CCC(NN)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of 1-[4-(trifluoromethyl)phenyl]propylhydrazine?
The InChIKey is VGAXHPZOILZPNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N2/c1-2-9(15-14)7-3-5-8(6-4-7)10(11,12)13/h3-6,9,15H,2,14H2,1H3.
What are the key properties of 1-[4-(trifluoromethyl)phenyl]propylhydrazine?
1-[4-(trifluoromethyl)phenyl]propylhydrazine has a molecular weight of 218.22 g/mol, XLogP of 2.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(trifluoromethyl)phenyl]propylhydrazine is sourced from PubChem (CID 70339292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).