[(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine

C14H18N2OS — CID 105326396

IUPAC[(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine
SMILESCCc1cccc(C(NN)c2sccc2OC)c1
InChIInChI=1S/C14H18N2OS/c1-3-10-5-4-6-11(9-10)13(16-15)14-12(17-2)7-8-18-14/h4-9,13,16H,3,15H2,1-2H3
InChIKeyQMBNMFRERKUNFC-UHFFFAOYSA-N
MW262.38 g/mol
LogP2.87
Rot. Bonds5

About [(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine

[(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine (PubChem CID 105326396) has the molecular formula C14H18N2OS and a molecular weight of 262.38 g/mol. Its IUPAC name is [(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine
PubChem CID105326396
Molecular FormulaC14H18N2OS
Molecular Weight262.38 g/mol
Exact Mass262.11
IUPAC Name[(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine
SMILESCCc1cccc(C(NN)c2sccc2OC)c1
InChIInChI=1S/C14H18N2OS/c1-3-10-5-4-6-11(9-10)13(16-15)14-12(17-2)7-8-18-14/h4-9,13,16H,3,15H2,1-2H3
InChIKeyQMBNMFRERKUNFC-UHFFFAOYSA-N
XLogP2.87
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 [(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine?
The IUPAC name of [(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine (CID 105326396) is [(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine?
The canonical SMILES for [(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine is CCc1cccc(C(NN)c2sccc2OC)c1.
What is the InChIKey of [(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine?
The InChIKey is QMBNMFRERKUNFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2OS/c1-3-10-5-4-6-11(9-10)13(16-15)14-12(17-2)7-8-18-14/h4-9,13,16H,3,15H2,1-2H3.
What are the key properties of [(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine?
[(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine has a molecular weight of 262.38 g/mol, XLogP of 2.87, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine is sourced from PubChem (CID 105326396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).