2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine

C10H10F6N2 — CID 15295109

IUPAC2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine
SMILESNNCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1
InChIInChI=1S/C10H10F6N2/c11-9(12,13)7-3-6(1-2-18-17)4-8(5-7)10(14,15)16/h3-5,18H,1-2,17H2
InChIKeyQYDGYHFGLCZDAE-UHFFFAOYSA-N
MW272.19 g/mol
LogP2.73
Rot. Bonds3

About 2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine

2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine (PubChem CID 15295109) has the molecular formula C10H10F6N2 and a molecular weight of 272.19 g/mol. Its IUPAC name is 2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine.

Molecular Properties

Compound Name2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine
PubChem CID15295109
Molecular FormulaC10H10F6N2
Molecular Weight272.19 g/mol
Exact Mass272.07
IUPAC Name2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine
SMILESNNCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1
InChIInChI=1S/C10H10F6N2/c11-9(12,13)7-3-6(1-2-18-17)4-8(5-7)10(14,15)16/h3-5,18H,1-2,17H2
InChIKeyQYDGYHFGLCZDAE-UHFFFAOYSA-N
XLogP2.73
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.19
LogP ≤ 52.73
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 2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine?
The IUPAC name of 2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine (CID 15295109) is 2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine.
What is the SMILES notation for 2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine?
The canonical SMILES for 2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine is NNCCc1cc(C(F)(F)F)cc(C(F)(F)F)c1.
What is the InChIKey of 2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine?
The InChIKey is QYDGYHFGLCZDAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F6N2/c11-9(12,13)7-3-6(1-2-18-17)4-8(5-7)10(14,15)16/h3-5,18H,1-2,17H2.
What are the key properties of 2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine?
2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine has a molecular weight of 272.19 g/mol, XLogP of 2.73, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3,5-bis(trifluoromethyl)phenyl]ethylhydrazine is sourced from PubChem (CID 15295109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).