[(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine

C11H9BrF2N2S — CID 105305003

IUPAC[(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine
SMILESNNC(c1csc(Br)c1)c1ccc(F)c(F)c1
InChIInChI=1S/C11H9BrF2N2S/c12-10-4-7(5-17-10)11(16-15)6-1-2-8(13)9(14)3-6/h1-5,11,16H,15H2
InChIKeyZZGDHIMAIQHAHV-UHFFFAOYSA-N
MW319.17 g/mol
LogP3.34
Rot. Bonds3

About [(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine

[(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine (PubChem CID 105305003) has the molecular formula C11H9BrF2N2S and a molecular weight of 319.17 g/mol. Its IUPAC name is [(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine
PubChem CID105305003
Molecular FormulaC11H9BrF2N2S
Molecular Weight319.17 g/mol
Exact Mass317.96
IUPAC Name[(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine
SMILESNNC(c1csc(Br)c1)c1ccc(F)c(F)c1
InChIInChI=1S/C11H9BrF2N2S/c12-10-4-7(5-17-10)11(16-15)6-1-2-8(13)9(14)3-6/h1-5,11,16H,15H2
InChIKeyZZGDHIMAIQHAHV-UHFFFAOYSA-N
XLogP3.34
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.17
LogP ≤ 53.34
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

[(3,4-difluorophenyl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105197212
[(5-bromothiophen-3-yl)-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105304305
[(3,4-difluorophenyl)-(3,4,5-trifluorophenyl)methyl]hydrazine
CID 105208117
[(4-chlorophenyl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105193316
[(S)-(3,4-difluorophenyl)-phenylmethyl]hydrazine
CID 124596469
[(4-fluoro-3-methylphenyl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105204191
[(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105305020
[(3,4-difluorophenyl)-pyridin-3-ylmethyl]hydrazine
CID 105196161
[(2-bromo-4-fluorophenyl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105304939
[(5-bromo-4-methylthiophen-2-yl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105304993
[(4-bromo-2-chlorophenyl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105304998
1-(5-bromothiophen-3-yl)-1-(4-chlorophenyl)-N-methylmethanamine
CID 105076520

Frequently Asked Questions

What is the IUPAC name of [(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine?
The IUPAC name of [(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine (CID 105305003) is [(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine?
The canonical SMILES for [(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine is NNC(c1csc(Br)c1)c1ccc(F)c(F)c1.
What is the InChIKey of [(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine?
The InChIKey is ZZGDHIMAIQHAHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrF2N2S/c12-10-4-7(5-17-10)11(16-15)6-1-2-8(13)9(14)3-6/h1-5,11,16H,15H2.
What are the key properties of [(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine?
[(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine has a molecular weight of 319.17 g/mol, XLogP of 3.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105305003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).