[1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine

C15H14F4N2 — CID 105223092

IUPAC[1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine
SMILESCc1ccc(F)c(C(Cc2ccc(F)cc2F)NN)c1F
InChIInChI=1S/C15H14F4N2/c1-8-2-5-11(17)14(15(8)19)13(21-20)6-9-3-4-10(16)7-12(9)18/h2-5,7,13,21H,6,20H2,1H3
InChIKeyTXJUROUKVPBLBH-UHFFFAOYSA-N
MW298.28 g/mol
LogP3.30
Rot. Bonds4

About [1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine

[1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine (PubChem CID 105223092) has the molecular formula C15H14F4N2 and a molecular weight of 298.28 g/mol. Its IUPAC name is [1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine
PubChem CID105223092
Molecular FormulaC15H14F4N2
Molecular Weight298.28 g/mol
Exact Mass298.11
IUPAC Name[1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine
SMILESCc1ccc(F)c(C(Cc2ccc(F)cc2F)NN)c1F
InChIInChI=1S/C15H14F4N2/c1-8-2-5-11(17)14(15(8)19)13(21-20)6-9-3-4-10(16)7-12(9)18/h2-5,7,13,21H,6,20H2,1H3
InChIKeyTXJUROUKVPBLBH-UHFFFAOYSA-N
XLogP3.30
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.28
LogP ≤ 53.30
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-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine?
The IUPAC name of [1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine (CID 105223092) is [1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine?
The canonical SMILES for [1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine is Cc1ccc(F)c(C(Cc2ccc(F)cc2F)NN)c1F.
What is the InChIKey of [1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine?
The InChIKey is TXJUROUKVPBLBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F4N2/c1-8-2-5-11(17)14(15(8)19)13(21-20)6-9-3-4-10(16)7-12(9)18/h2-5,7,13,21H,6,20H2,1H3.
What are the key properties of [1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine?
[1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine has a molecular weight of 298.28 g/mol, XLogP of 3.30, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 105223092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).