[1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine

C13H19BrN4S — CID 105323417

IUPAC[1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine
SMILESCCCn1ccnc1CC(NN)c1cc(C)c(Br)s1
InChIInChI=1S/C13H19BrN4S/c1-3-5-18-6-4-16-12(18)8-10(17-15)11-7-9(2)13(14)19-11/h4,6-7,10,17H,3,5,8,15H2,1-2H3
InChIKeyBXTGCLSBUZULET-UHFFFAOYSA-N
MW343.29 g/mol
LogP3.17
Rot. Bonds6

About [1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine

[1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine (PubChem CID 105323417) has the molecular formula C13H19BrN4S and a molecular weight of 343.29 g/mol. Its IUPAC name is [1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine
PubChem CID105323417
Molecular FormulaC13H19BrN4S
Molecular Weight343.29 g/mol
Exact Mass342.05
IUPAC Name[1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine
SMILESCCCn1ccnc1CC(NN)c1cc(C)c(Br)s1
InChIInChI=1S/C13H19BrN4S/c1-3-5-18-6-4-16-12(18)8-10(17-15)11-7-9(2)13(14)19-11/h4,6-7,10,17H,3,5,8,15H2,1-2H3
InChIKeyBXTGCLSBUZULET-UHFFFAOYSA-N
XLogP3.17
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.29
LogP ≤ 53.17
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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Related Compounds

[1-(5-bromo-4-methylthiophen-2-yl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 105321894
[1-(4-bromo-2-methylphenyl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine
CID 105323298
1-(5-bromo-4-methylthiophen-2-yl)-N-ethyl-2-(1-methylimidazol-2-yl)ethanamine
CID 105011239
1-(4,5-dibromothiophen-2-yl)-2-(1-propylimidazol-2-yl)ethanamine
CID 105012264
[1-(2-bromo-4-methylphenyl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine
CID 105323345
[1-(5-bromo-3-pyridinyl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine
CID 105251280
N-[(5-bromo-4-methylthiophen-2-yl)-(1-propylimidazol-2-yl)methyl]ethanamine
CID 79996590
[1-(3,6-dimethylpyridazin-4-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine
CID 105323436
[1-(5-bromo-4-methylthiophen-2-yl)-2-[2-(2-methylpropyl)-1,2,4-triazol-3-yl]ethyl]hydrazine
CID 105317711
[1-(5-bromo-4-methylthiophen-2-yl)-2-(2,5-dimethylpyrazol-3-yl)ethyl]hydrazine
CID 105315837
[1-(4-bromothiophen-2-yl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 105222666
[1-(5-bromo-4-methylthiophen-2-yl)-2-(1-methylbenzimidazol-2-yl)ethyl]hydrazine
CID 105321073

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine?
The IUPAC name of [1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine (CID 105323417) is [1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine?
The canonical SMILES for [1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine is CCCn1ccnc1CC(NN)c1cc(C)c(Br)s1.
What is the InChIKey of [1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine?
The InChIKey is BXTGCLSBUZULET-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19BrN4S/c1-3-5-18-6-4-16-12(18)8-10(17-15)11-7-9(2)13(14)19-11/h4,6-7,10,17H,3,5,8,15H2,1-2H3.
What are the key properties of [1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine?
[1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine has a molecular weight of 343.29 g/mol, XLogP of 3.17, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromo-4-methylthiophen-2-yl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105323417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).