[2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine

C17H18F4N2 — CID 15001652

IUPAC[2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine
SMILESCCCCCc1ccc(-c2c(F)c(F)c(NN)c(F)c2F)cc1
InChIInChI=1S/C17H18F4N2/c1-2-3-4-5-10-6-8-11(9-7-10)12-13(18)15(20)17(23-22)16(21)14(12)19/h6-9,23H,2-5,22H2,1H3
InChIKeyWLVIKMWAPXWIQH-UHFFFAOYSA-N
MW326.34 g/mol
LogP4.93
Rot. Bonds6

About [2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine

[2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine (PubChem CID 15001652) has the molecular formula C17H18F4N2 and a molecular weight of 326.34 g/mol. Its IUPAC name is [2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine.

Molecular Properties

Compound Name[2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine
PubChem CID15001652
Molecular FormulaC17H18F4N2
Molecular Weight326.34 g/mol
Exact Mass326.14
IUPAC Name[2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine
SMILESCCCCCc1ccc(-c2c(F)c(F)c(NN)c(F)c2F)cc1
InChIInChI=1S/C17H18F4N2/c1-2-3-4-5-10-6-8-11(9-7-10)12-13(18)15(20)17(23-22)16(21)14(12)19/h6-9,23H,2-5,22H2,1H3
InChIKeyWLVIKMWAPXWIQH-UHFFFAOYSA-N
XLogP4.93
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.34
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'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 [2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine?
The IUPAC name of [2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine (CID 15001652) is [2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine.
What is the SMILES notation for [2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine?
The canonical SMILES for [2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine is CCCCCc1ccc(-c2c(F)c(F)c(NN)c(F)c2F)cc1.
What is the InChIKey of [2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine?
The InChIKey is WLVIKMWAPXWIQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18F4N2/c1-2-3-4-5-10-6-8-11(9-7-10)12-13(18)15(20)17(23-22)16(21)14(12)19/h6-9,23H,2-5,22H2,1H3.
What are the key properties of [2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine?
[2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine has a molecular weight of 326.34 g/mol, XLogP of 4.93, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2,3,5,6-tetrafluoro-4-(4-pentylphenyl)phenyl]hydrazine is sourced from PubChem (CID 15001652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).