[(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine

C13H15ClN2S — CID 105286685

IUPAC[(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine
SMILESCc1cc(C)cc(C(NN)c2sccc2Cl)c1
InChIInChI=1S/C13H15ClN2S/c1-8-5-9(2)7-10(6-8)12(16-15)13-11(14)3-4-17-13/h3-7,12,16H,15H2,1-2H3
InChIKeyQEMDKPZGCYTWOC-UHFFFAOYSA-N
MW266.80 g/mol
LogP3.57
Rot. Bonds3

About [(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine

[(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine (PubChem CID 105286685) has the molecular formula C13H15ClN2S and a molecular weight of 266.80 g/mol. Its IUPAC name is [(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine
PubChem CID105286685
Molecular FormulaC13H15ClN2S
Molecular Weight266.80 g/mol
Exact Mass266.06
IUPAC Name[(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine
SMILESCc1cc(C)cc(C(NN)c2sccc2Cl)c1
InChIInChI=1S/C13H15ClN2S/c1-8-5-9(2)7-10(6-8)12(16-15)13-11(14)3-4-17-13/h3-7,12,16H,15H2,1-2H3
InChIKeyQEMDKPZGCYTWOC-UHFFFAOYSA-N
XLogP3.57
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.80
LogP ≤ 53.57
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-chlorothiophen-2-yl)-(2,5-dimethylphenyl)methyl]hydrazine
CID 105292490
[(3-chlorothiophen-2-yl)-(4-methoxyphenyl)methyl]hydrazine
CID 105286186
[(3-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine
CID 107362142
2-[bromo-(3,5-dimethylphenyl)methyl]-3-chlorothiophene
CID 80530329
[(3-chlorothiophen-2-yl)-(3-iodophenyl)methyl]hydrazine
CID 107362239
[(3-chlorothiophen-2-yl)-(2-methoxy-4-methylphenyl)methyl]hydrazine
CID 107362226
[(3-chlorothiophen-2-yl)-(3-ethylthiophen-2-yl)methyl]hydrazine
CID 107362343
[(3-chlorothiophen-2-yl)-(6-methoxypyrimidin-4-yl)methyl]hydrazine
CID 107362215
[(3-chlorothiophen-2-yl)-(5-chlorothiophen-2-yl)methyl]hydrazine
CID 105328155
[(3-chlorothiophen-2-yl)-(2-methoxy-3,4-dimethylphenyl)methyl]hydrazine
CID 103436227
2-[bromo-(3-chloro-5-methylphenyl)methyl]-3-chlorothiophene
CID 81324150
[(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105192528

Frequently Asked Questions

What is the IUPAC name of [(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine?
The IUPAC name of [(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine (CID 105286685) is [(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine.
What is the SMILES notation for [(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine?
The canonical SMILES for [(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine is Cc1cc(C)cc(C(NN)c2sccc2Cl)c1.
What is the InChIKey of [(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine?
The InChIKey is QEMDKPZGCYTWOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2S/c1-8-5-9(2)7-10(6-8)12(16-15)13-11(14)3-4-17-13/h3-7,12,16H,15H2,1-2H3.
What are the key properties of [(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine?
[(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine has a molecular weight of 266.80 g/mol, XLogP of 3.57, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-chlorothiophen-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine is sourced from PubChem (CID 105286685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).