[(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine

C11H9BrF2N2O — CID 105305020

IUPAC[(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(F)c(F)c1)c1ccc(Br)o1
InChIInChI=1S/C11H9BrF2N2O/c12-10-4-3-9(17-10)11(16-15)6-1-2-7(13)8(14)5-6/h1-5,11,16H,15H2
InChIKeyZBHRLWOFGVLNJD-UHFFFAOYSA-N
MW303.11 g/mol
LogP2.87
Rot. Bonds3

About [(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine

[(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine (PubChem CID 105305020) has the molecular formula C11H9BrF2N2O and a molecular weight of 303.11 g/mol. Its IUPAC name is [(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine
PubChem CID105305020
Molecular FormulaC11H9BrF2N2O
Molecular Weight303.11 g/mol
Exact Mass301.99
IUPAC Name[(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(F)c(F)c1)c1ccc(Br)o1
InChIInChI=1S/C11H9BrF2N2O/c12-10-4-3-9(17-10)11(16-15)6-1-2-7(13)8(14)5-6/h1-5,11,16H,15H2
InChIKeyZBHRLWOFGVLNJD-UHFFFAOYSA-N
XLogP2.87
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.11
LogP ≤ 52.87
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

[(5-bromofuran-2-yl)-[3-fluoro-4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 107292488
N-[(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]ethanamine
CID 43491302
[(5-bromofuran-2-yl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 105288205
[(5-bromofuran-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105286828
[(2-bromo-4-fluorophenyl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105304939
[(5-bromofuran-2-yl)-(4-phenylphenyl)methyl]hydrazine
CID 105310528
[(3,4-difluorophenyl)-(3,4,5-trifluorophenyl)methyl]hydrazine
CID 105208117
[(4-chlorophenyl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105193316
[(5-bromothiophen-3-yl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105305003
1-(5-bromofuran-2-yl)-1-(3-chloro-4-fluorophenyl)-N-methylmethanamine
CID 82874924
[(S)-(3,4-difluorophenyl)-phenylmethyl]hydrazine
CID 124596469
[(3-fluoro-4-methylphenyl)-(5-methylfuran-2-yl)methyl]hydrazine
CID 107130968

Frequently Asked Questions

What is the IUPAC name of [(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine?
The IUPAC name of [(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine (CID 105305020) is [(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine?
The canonical SMILES for [(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine is NNC(c1ccc(F)c(F)c1)c1ccc(Br)o1.
What is the InChIKey of [(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine?
The InChIKey is ZBHRLWOFGVLNJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrF2N2O/c12-10-4-3-9(17-10)11(16-15)6-1-2-7(13)8(14)5-6/h1-5,11,16H,15H2.
What are the key properties of [(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine?
[(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine has a molecular weight of 303.11 g/mol, XLogP of 2.87, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-bromofuran-2-yl)-(3,4-difluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105305020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).