[1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine

C15H18BrFN2S — CID 105296704

IUPAC[1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine
SMILESNNC(CCCc1cccs1)Cc1ccc(F)cc1Br
InChIInChI=1S/C15H18BrFN2S/c16-15-10-12(17)7-6-11(15)9-13(19-18)3-1-4-14-5-2-8-20-14/h2,5-8,10,13,19H,1,3-4,9,18H2
InChIKeyNZXNDELUFSNHIQ-UHFFFAOYSA-N
MW357.29 g/mol
LogP4.05
Rot. Bonds7

About [1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine

[1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine (PubChem CID 105296704) has the molecular formula C15H18BrFN2S and a molecular weight of 357.29 g/mol. Its IUPAC name is [1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine
PubChem CID105296704
Molecular FormulaC15H18BrFN2S
Molecular Weight357.29 g/mol
Exact Mass356.04
IUPAC Name[1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine
SMILESNNC(CCCc1cccs1)Cc1ccc(F)cc1Br
InChIInChI=1S/C15H18BrFN2S/c16-15-10-12(17)7-6-11(15)9-13(19-18)3-1-4-14-5-2-8-20-14/h2,5-8,10,13,19H,1,3-4,9,18H2
InChIKeyNZXNDELUFSNHIQ-UHFFFAOYSA-N
XLogP4.05
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.29
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[1-(4-bromo-2-chlorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine
CID 105335240
[1-(4-fluoro-2-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine
CID 105211952
1-(2-chloro-4-fluorophenyl)-5-thiophen-2-ylpentan-2-amine
CID 105133282
[1-(2-bromo-4-fluorophenyl)-4-pyridin-3-ylbutan-2-yl]hydrazine
CID 105296709
[1-(2-bromo-4-fluorophenyl)-4-ethoxybutan-2-yl]hydrazine
CID 105296727
2-(2-bromo-4-fluorophenyl)-1-thiophen-2-ylethanamine
CID 62608112
2-(2-bromo-4-fluorophenyl)-1-thiophen-2-ylethanol
CID 62607396
1-thiophen-2-yltetradecan-4-ylhydrazine
CID 105298385
(7-methyl-1-thiophen-2-yloct-7-en-4-yl)hydrazine
CID 105335936
(1-pyridin-3-yl-5-thiophen-2-ylpentan-2-yl)hydrazine
CID 105333745
1-(2-chloro-4-fluorophenyl)-5-thiophen-2-ylpentan-2-ol
CID 105086949
[1-(2,5-dimethylpyrazol-3-yl)-5-thiophen-2-ylpentan-2-yl]hydrazine
CID 105315827

Frequently Asked Questions

What is the IUPAC name of [1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine?
The IUPAC name of [1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine (CID 105296704) is [1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine.
What is the SMILES notation for [1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine?
The canonical SMILES for [1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine is NNC(CCCc1cccs1)Cc1ccc(F)cc1Br.
What is the InChIKey of [1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine?
The InChIKey is NZXNDELUFSNHIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18BrFN2S/c16-15-10-12(17)7-6-11(15)9-13(19-18)3-1-4-14-5-2-8-20-14/h2,5-8,10,13,19H,1,3-4,9,18H2.
What are the key properties of [1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine?
[1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine has a molecular weight of 357.29 g/mol, XLogP of 4.05, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromo-4-fluorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine is sourced from PubChem (CID 105296704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).