[1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine

C14H12BrF3N2 — CID 106945264

IUPAC[1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine
SMILESNNC(Cc1cccc(F)c1)c1c(F)ccc(Br)c1F
InChIInChI=1S/C14H12BrF3N2/c15-10-4-5-11(17)13(14(10)18)12(20-19)7-8-2-1-3-9(16)6-8/h1-6,12,20H,7,19H2
InChIKeyFEXGGOSACVYPFU-UHFFFAOYSA-N
MW345.16 g/mol
LogP3.61
Rot. Bonds4

About [1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine

[1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine (PubChem CID 106945264) has the molecular formula C14H12BrF3N2 and a molecular weight of 345.16 g/mol. Its IUPAC name is [1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine
PubChem CID106945264
Molecular FormulaC14H12BrF3N2
Molecular Weight345.16 g/mol
Exact Mass344.01
IUPAC Name[1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine
SMILESNNC(Cc1cccc(F)c1)c1c(F)ccc(Br)c1F
InChIInChI=1S/C14H12BrF3N2/c15-10-4-5-11(17)13(14(10)18)12(20-19)7-8-2-1-3-9(16)6-8/h1-6,12,20H,7,19H2
InChIKeyFEXGGOSACVYPFU-UHFFFAOYSA-N
XLogP3.61
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.16
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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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Related Compounds

[1-(3-bromo-2-fluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine
CID 106648688
[1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine
CID 105286398
[2-(3-bromo-4-fluorophenyl)-1-(3-fluorophenyl)ethyl]hydrazine
CID 105192894
[1-(4-bromo-3-methylphenyl)-2-(3-fluorophenyl)ethyl]hydrazine
CID 105286334
[2-(3-bromo-2,6-difluorophenyl)-1-(3-fluorophenyl)ethyl]hydrazine
CID 106270697
1-(3-bromo-2,6-difluorophenyl)-2-(3-bromophenyl)ethanol
CID 106941936
[1-(4-bromo-2,6-difluorophenyl)-2-(3-bromophenyl)ethyl]hydrazine
CID 105284643
1-(3-bromo-2,6-difluorophenyl)-2-(3,4-difluorophenyl)-N-methylethanamine
CID 106944913
[1-(3-bromo-2,6-difluorophenyl)-4,4,4-trifluorobutyl]hydrazine
CID 106945388
1-(2-bromo-6-fluorophenyl)-2-(3-fluorophenyl)ethanamine
CID 114559896
1-(3-bromo-2,6-difluorophenyl)-2-(3-chlorophenyl)ethanamine
CID 106942201
[1-(2-bromo-5-fluorophenyl)-2-(3,4-difluorophenyl)ethyl]hydrazine
CID 105330420

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine?
The IUPAC name of [1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine (CID 106945264) is [1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine?
The canonical SMILES for [1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine is NNC(Cc1cccc(F)c1)c1c(F)ccc(Br)c1F.
What is the InChIKey of [1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine?
The InChIKey is FEXGGOSACVYPFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrF3N2/c15-10-4-5-11(17)13(14(10)18)12(20-19)7-8-2-1-3-9(16)6-8/h1-6,12,20H,7,19H2.
What are the key properties of [1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine?
[1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine has a molecular weight of 345.16 g/mol, XLogP of 3.61, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromo-2,6-difluorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 106945264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).