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

C11H19BrN2S — CID 105222482

IUPAC[1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine
SMILESCCCC(C)CC(NN)c1cc(Br)cs1
InChIInChI=1S/C11H19BrN2S/c1-3-4-8(2)5-10(14-13)11-6-9(12)7-15-11/h6-8,10,14H,3-5,13H2,1-2H3
InChIKeyAMZOGVMPLOTZKV-UHFFFAOYSA-N
MW291.26 g/mol
LogP3.84
Rot. Bonds6

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

[1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine (PubChem CID 105222482) has the molecular formula C11H19BrN2S and a molecular weight of 291.26 g/mol. Its IUPAC name is [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine.

Molecular Properties

Compound Name[1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine
PubChem CID105222482
Molecular FormulaC11H19BrN2S
Molecular Weight291.26 g/mol
Exact Mass290.05
IUPAC Name[1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine
SMILESCCCC(C)CC(NN)c1cc(Br)cs1
InChIInChI=1S/C11H19BrN2S/c1-3-4-8(2)5-10(14-13)11-6-9(12)7-15-11/h6-8,10,14H,3-5,13H2,1-2H3
InChIKeyAMZOGVMPLOTZKV-UHFFFAOYSA-N
XLogP3.84
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.26
LogP ≤ 53.84
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'}

Analyze [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine?
The IUPAC name of [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine (CID 105222482) is [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine.
What is the SMILES notation for [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine?
The canonical SMILES for [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine is CCCC(C)CC(NN)c1cc(Br)cs1.
What is the InChIKey of [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine?
The InChIKey is AMZOGVMPLOTZKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19BrN2S/c1-3-4-8(2)5-10(14-13)11-6-9(12)7-15-11/h6-8,10,14H,3-5,13H2,1-2H3.
What are the key properties of [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine?
[1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine has a molecular weight of 291.26 g/mol, XLogP of 3.84, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine is sourced from PubChem (CID 105222482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).