[(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine

C11H9BrClFN2S — CID 105215506

IUPAC[(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(F)cc1Cl)c1sccc1Br
InChIInChI=1S/C11H9BrClFN2S/c12-8-3-4-17-11(8)10(16-15)7-2-1-6(14)5-9(7)13/h1-5,10,16H,15H2
InChIKeyOLFQWXYMFWHEIF-UHFFFAOYSA-N
MW335.63 g/mol
LogP3.86
Rot. Bonds3

About [(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine

[(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine (PubChem CID 105215506) has the molecular formula C11H9BrClFN2S and a molecular weight of 335.63 g/mol. Its IUPAC name is [(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine
PubChem CID105215506
Molecular FormulaC11H9BrClFN2S
Molecular Weight335.63 g/mol
Exact Mass333.93
IUPAC Name[(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(F)cc1Cl)c1sccc1Br
InChIInChI=1S/C11H9BrClFN2S/c12-8-3-4-17-11(8)10(16-15)7-2-1-6(14)5-9(7)13/h1-5,10,16H,15H2
InChIKeyOLFQWXYMFWHEIF-UHFFFAOYSA-N
XLogP3.86
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.63
LogP ≤ 53.86
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-bromo-4-fluorophenyl)-(3-chlorothiophen-2-yl)methyl]hydrazine
CID 107362233
[1-(3-bromothiophen-2-yl)-2-(2-chloro-5-fluorophenyl)ethyl]hydrazine
CID 102623486
1-(4-bromo-2-chlorophenyl)-1-(3-bromothiophen-2-yl)-N-methylmethanamine
CID 80535100
[(3-bromothiophen-2-yl)-(3,4,5-trifluorophenyl)methyl]hydrazine
CID 105208216
[(3-bromothiophen-2-yl)-(4-bromothiophen-2-yl)methyl]hydrazine
CID 105222634
[(2-bromo-3,4-difluorophenyl)-(3-chlorothiophen-2-yl)methyl]hydrazine
CID 107541175
(3-bromothiophen-2-yl)-(2,4-difluorophenyl)methanamine
CID 63798437
[(2,4-dichlorophenyl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 105322333
[(4-bromo-2-chlorophenyl)-(2,5-difluorophenyl)methyl]hydrazine
CID 105303405
[(3-bromothiophen-2-yl)-(2,4,5-trimethoxyphenyl)methyl]hydrazine
CID 105327817
1-(3-bromothiophen-2-yl)-1-(2-chloro-4-methoxyphenyl)-N-methylmethanamine
CID 63796523
(2-bromo-4-fluorophenyl)-(3-bromothiophen-2-yl)methanol
CID 80535969

Frequently Asked Questions

What is the IUPAC name of [(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine?
The IUPAC name of [(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine (CID 105215506) is [(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine?
The canonical SMILES for [(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine is NNC(c1ccc(F)cc1Cl)c1sccc1Br.
What is the InChIKey of [(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine?
The InChIKey is OLFQWXYMFWHEIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrClFN2S/c12-8-3-4-17-11(8)10(16-15)7-2-1-6(14)5-9(7)13/h1-5,10,16H,15H2.
What are the key properties of [(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine?
[(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine has a molecular weight of 335.63 g/mol, XLogP of 3.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromothiophen-2-yl)-(2-chloro-4-fluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105215506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).