1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine

C16H18F2N2 — CID 105377773

IUPAC1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine
SMILESCc1ccc(F)cc1CC(NN)c1cc(F)ccc1C
InChIInChI=1S/C16H18F2N2/c1-10-3-5-13(17)7-12(10)8-16(20-19)15-9-14(18)6-4-11(15)2/h3-7,9,16,20H,8,19H2,1-2H3
InChIKeyQFEAKKHXLCAVKV-UHFFFAOYSA-N
MW276.33 g/mol
LogP3.33
Rot. Bonds4

About 1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine

1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine (PubChem CID 105377773) has the molecular formula C16H18F2N2 and a molecular weight of 276.33 g/mol. Its IUPAC name is 1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine.

Molecular Properties

Compound Name1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine
PubChem CID105377773
Molecular FormulaC16H18F2N2
Molecular Weight276.33 g/mol
Exact Mass276.14
IUPAC Name1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine
SMILESCc1ccc(F)cc1CC(NN)c1cc(F)ccc1C
InChIInChI=1S/C16H18F2N2/c1-10-3-5-13(17)7-12(10)8-16(20-19)15-9-14(18)6-4-11(15)2/h3-7,9,16,20H,8,19H2,1-2H3
InChIKeyQFEAKKHXLCAVKV-UHFFFAOYSA-N
XLogP3.33
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.33
LogP ≤ 53.33
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'}

Analyze 1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine?
The IUPAC name of 1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine (CID 105377773) is 1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine.
What is the SMILES notation for 1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine?
The canonical SMILES for 1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine is Cc1ccc(F)cc1CC(NN)c1cc(F)ccc1C.
What is the InChIKey of 1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine?
The InChIKey is QFEAKKHXLCAVKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18F2N2/c1-10-3-5-13(17)7-12(10)8-16(20-19)15-9-14(18)6-4-11(15)2/h3-7,9,16,20H,8,19H2,1-2H3.
What are the key properties of 1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine?
1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine has a molecular weight of 276.33 g/mol, XLogP of 3.33, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine is sourced from PubChem (CID 105377773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).