[2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine

C11H13BrN2OS2 — CID 105299660

IUPAC[2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine
SMILESCOc1csc(C(Cc2sccc2Br)NN)c1
InChIInChI=1S/C11H13BrN2OS2/c1-15-7-4-11(17-6-7)9(14-13)5-10-8(12)2-3-16-10/h2-4,6,9,14H,5,13H2,1H3
InChIKeyJWLKJKBYVORETF-UHFFFAOYSA-N
MW333.28 g/mol
LogP3.33
Rot. Bonds5

About [2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine

[2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine (PubChem CID 105299660) has the molecular formula C11H13BrN2OS2 and a molecular weight of 333.28 g/mol. Its IUPAC name is [2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine
PubChem CID105299660
Molecular FormulaC11H13BrN2OS2
Molecular Weight333.28 g/mol
Exact Mass331.97
IUPAC Name[2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine
SMILESCOc1csc(C(Cc2sccc2Br)NN)c1
InChIInChI=1S/C11H13BrN2OS2/c1-15-7-4-11(17-6-7)9(14-13)5-10-8(12)2-3-16-10/h2-4,6,9,14H,5,13H2,1H3
InChIKeyJWLKJKBYVORETF-UHFFFAOYSA-N
XLogP3.33
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.28
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 [2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine (CID 105299660) is [2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine is COc1csc(C(Cc2sccc2Br)NN)c1.
What is the InChIKey of [2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine?
The InChIKey is JWLKJKBYVORETF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrN2OS2/c1-15-7-4-11(17-6-7)9(14-13)5-10-8(12)2-3-16-10/h2-4,6,9,14H,5,13H2,1H3.
What are the key properties of [2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine?
[2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine has a molecular weight of 333.28 g/mol, XLogP of 3.33, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-bromothiophen-2-yl)-1-(4-methoxythiophen-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105299660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).