[(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine

C13H15ClN2S — CID 105328291

IUPAC[(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine
SMILESCCc1ccccc1C(NN)c1ccc(Cl)s1
InChIInChI=1S/C13H15ClN2S/c1-2-9-5-3-4-6-10(9)13(16-15)11-7-8-12(14)17-11/h3-8,13,16H,2,15H2,1H3
InChIKeyHQCDNXMLYDZRFU-UHFFFAOYSA-N
MW266.80 g/mol
LogP3.52
Rot. Bonds4

About [(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine

[(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine (PubChem CID 105328291) has the molecular formula C13H15ClN2S and a molecular weight of 266.80 g/mol. Its IUPAC name is [(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine
PubChem CID105328291
Molecular FormulaC13H15ClN2S
Molecular Weight266.80 g/mol
Exact Mass266.06
IUPAC Name[(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine
SMILESCCc1ccccc1C(NN)c1ccc(Cl)s1
InChIInChI=1S/C13H15ClN2S/c1-2-9-5-3-4-6-10(9)13(16-15)11-7-8-12(14)17-11/h3-8,13,16H,2,15H2,1H3
InChIKeyHQCDNXMLYDZRFU-UHFFFAOYSA-N
XLogP3.52
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.80
LogP ≤ 53.52
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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Frequently Asked Questions

What is the IUPAC name of [(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine?
The IUPAC name of [(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine (CID 105328291) is [(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine.
What is the SMILES notation for [(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine?
The canonical SMILES for [(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine is CCc1ccccc1C(NN)c1ccc(Cl)s1.
What is the InChIKey of [(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine?
The InChIKey is HQCDNXMLYDZRFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2S/c1-2-9-5-3-4-6-10(9)13(16-15)11-7-8-12(14)17-11/h3-8,13,16H,2,15H2,1H3.
What are the key properties of [(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine?
[(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine has a molecular weight of 266.80 g/mol, XLogP of 3.52, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-chlorothiophen-2-yl)-(2-ethylphenyl)methyl]hydrazine is sourced from PubChem (CID 105328291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).