[(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine

C12H11BrF2N2S — CID 105318829

IUPAC[(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine
SMILESCc1ccc(C(NN)c2c(F)cc(Br)cc2F)s1
InChIInChI=1S/C12H11BrF2N2S/c1-6-2-3-10(18-6)12(17-16)11-8(14)4-7(13)5-9(11)15/h2-5,12,17H,16H2,1H3
InChIKeyZDYHOUOQRWNKDK-UHFFFAOYSA-N
MW333.20 g/mol
LogP3.65
Rot. Bonds3

About [(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine

[(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine (PubChem CID 105318829) has the molecular formula C12H11BrF2N2S and a molecular weight of 333.20 g/mol. Its IUPAC name is [(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine
PubChem CID105318829
Molecular FormulaC12H11BrF2N2S
Molecular Weight333.20 g/mol
Exact Mass331.98
IUPAC Name[(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine
SMILESCc1ccc(C(NN)c2c(F)cc(Br)cc2F)s1
InChIInChI=1S/C12H11BrF2N2S/c1-6-2-3-10(18-6)12(17-16)11-8(14)4-7(13)5-9(11)15/h2-5,12,17H,16H2,1H3
InChIKeyZDYHOUOQRWNKDK-UHFFFAOYSA-N
XLogP3.65
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.20
LogP ≤ 53.65
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

[(2-fluoro-4,6-dimethylphenyl)-(5-methylthiophen-2-yl)methyl]hydrazine
CID 106884633
[(4-bromo-2,6-difluorophenyl)-thiophen-2-ylmethyl]hydrazine
CID 105287644
[(3-fluoro-4-methylphenyl)-(5-methylthiophen-2-yl)methyl]hydrazine
CID 105201488
[(4,5-dibromothiophen-2-yl)-(5-methylthiophen-2-yl)methyl]hydrazine
CID 105318815
[(4-bromo-2,6-difluorophenyl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 102843340
[(4-bromo-2,6-difluorophenyl)-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105304334
[(2,3-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine
CID 105309299
1-(2,6-difluoro-4-methoxyphenyl)-N-methyl-1-(5-methylthiophen-2-yl)methanamine
CID 54880468
[(5-methylthiophen-2-yl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105313203
[(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine
CID 105303288
[(2-chloro-4-methylphenyl)-(5-methylthiophen-2-yl)methyl]hydrazine
CID 106860041
[(3-bromo-4-methoxyphenyl)-(5-methylthiophen-2-yl)methyl]hydrazine
CID 105318789

Frequently Asked Questions

What is the IUPAC name of [(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine?
The IUPAC name of [(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine (CID 105318829) is [(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine.
What is the SMILES notation for [(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine?
The canonical SMILES for [(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine is Cc1ccc(C(NN)c2c(F)cc(Br)cc2F)s1.
What is the InChIKey of [(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine?
The InChIKey is ZDYHOUOQRWNKDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrF2N2S/c1-6-2-3-10(18-6)12(17-16)11-8(14)4-7(13)5-9(11)15/h2-5,12,17H,16H2,1H3.
What are the key properties of [(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine?
[(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine has a molecular weight of 333.20 g/mol, XLogP of 3.65, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-bromo-2,6-difluorophenyl)-(5-methylthiophen-2-yl)methyl]hydrazine is sourced from PubChem (CID 105318829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).