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

C12H12ClFN2S — CID 103408457

IUPAC[(3-chloro-4-methylthiophen-2-yl)-(2-fluorophenyl)methyl]hydrazine
SMILESCc1csc(C(NN)c2ccccc2F)c1Cl
InChIInChI=1S/C12H12ClFN2S/c1-7-6-17-12(10(7)13)11(16-15)8-4-2-3-5-9(8)14/h2-6,11,16H,15H2,1H3
InChIKeyMOKOKLVPSOJDGJ-UHFFFAOYSA-N
MW270.76 g/mol
LogP3.40
Rot. Bonds3

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

[(3-chloro-4-methylthiophen-2-yl)-(2-fluorophenyl)methyl]hydrazine (PubChem CID 103408457) has the molecular formula C12H12ClFN2S and a molecular weight of 270.76 g/mol. Its IUPAC name is [(3-chloro-4-methylthiophen-2-yl)-(2-fluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-chloro-4-methylthiophen-2-yl)-(2-fluorophenyl)methyl]hydrazine
PubChem CID103408457
Molecular FormulaC12H12ClFN2S
Molecular Weight270.76 g/mol
Exact Mass270.04
IUPAC Name[(3-chloro-4-methylthiophen-2-yl)-(2-fluorophenyl)methyl]hydrazine
SMILESCc1csc(C(NN)c2ccccc2F)c1Cl
InChIInChI=1S/C12H12ClFN2S/c1-7-6-17-12(10(7)13)11(16-15)8-4-2-3-5-9(8)14/h2-6,11,16H,15H2,1H3
InChIKeyMOKOKLVPSOJDGJ-UHFFFAOYSA-N
XLogP3.40
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 53.40
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-chloro-4-methylthiophen-2-yl)-(2,3-dichlorophenyl)methyl]hydrazine
CID 103408548
[(3-chloro-4-methylthiophen-2-yl)-phenylmethyl]hydrazine
CID 103408376
[(3-chloro-4-methylthiophen-2-yl)-isoquinolin-4-ylmethyl]hydrazine
CID 103408597
[(5-chloro-2-methylphenyl)-(2-fluorophenyl)methyl]hydrazine
CID 105292450
1-(3-chloro-4-methylthiophen-2-yl)-1-(2-chlorophenyl)-N-methylmethanamine
CID 103405291
1-(3-chloro-4-methylthiophen-2-yl)-N-methyl-1-[2-(trifluoromethyl)phenyl]methanamine
CID 103405957
[(3-bromo-2,4-dimethoxyphenyl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine
CID 103524729
[(2-bromo-3-methylphenyl)-(2-fluorophenyl)methyl]hydrazine
CID 107985973
[(3-chloro-4-methylthiophen-2-yl)-(3-methoxyphenyl)methyl]hydrazine
CID 103408381
N-[(3-chloro-4-methylthiophen-2-yl)-(2-fluoro-5-methylphenyl)methyl]ethanamine
CID 103405896
[(2,5-dimethylphenyl)-(2-fluorophenyl)methyl]hydrazine
CID 105216831
1-(3-chloro-4-methylthiophen-2-yl)-1-(2-fluoro-4-methoxyphenyl)-N-methylmethanamine
CID 103400975

Frequently Asked Questions

What is the IUPAC name of [(3-chloro-4-methylthiophen-2-yl)-(2-fluorophenyl)methyl]hydrazine?
The IUPAC name of [(3-chloro-4-methylthiophen-2-yl)-(2-fluorophenyl)methyl]hydrazine (CID 103408457) is [(3-chloro-4-methylthiophen-2-yl)-(2-fluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(3-chloro-4-methylthiophen-2-yl)-(2-fluorophenyl)methyl]hydrazine?
The canonical SMILES for [(3-chloro-4-methylthiophen-2-yl)-(2-fluorophenyl)methyl]hydrazine is Cc1csc(C(NN)c2ccccc2F)c1Cl.
What is the InChIKey of [(3-chloro-4-methylthiophen-2-yl)-(2-fluorophenyl)methyl]hydrazine?
The InChIKey is MOKOKLVPSOJDGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClFN2S/c1-7-6-17-12(10(7)13)11(16-15)8-4-2-3-5-9(8)14/h2-6,11,16H,15H2,1H3.
What are the key properties of [(3-chloro-4-methylthiophen-2-yl)-(2-fluorophenyl)methyl]hydrazine?
[(3-chloro-4-methylthiophen-2-yl)-(2-fluorophenyl)methyl]hydrazine has a molecular weight of 270.76 g/mol, XLogP of 3.40, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-chloro-4-methylthiophen-2-yl)-(2-fluorophenyl)methyl]hydrazine is sourced from PubChem (CID 103408457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).