[1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine

C9H15BrN2OS — CID 105342588

IUPAC[1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine
SMILESCOCCCC(NN)c1csc(Br)c1
InChIInChI=1S/C9H15BrN2OS/c1-13-4-2-3-8(12-11)7-5-9(10)14-6-7/h5-6,8,12H,2-4,11H2,1H3
InChIKeyXEYPFYWMMGMYDE-UHFFFAOYSA-N
MW279.20 g/mol
LogP2.44
Rot. Bonds6

About [1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine

[1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine (PubChem CID 105342588) has the molecular formula C9H15BrN2OS and a molecular weight of 279.20 g/mol. Its IUPAC name is [1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine.

Molecular Properties

Compound Name[1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine
PubChem CID105342588
Molecular FormulaC9H15BrN2OS
Molecular Weight279.20 g/mol
Exact Mass278.01
IUPAC Name[1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine
SMILESCOCCCC(NN)c1csc(Br)c1
InChIInChI=1S/C9H15BrN2OS/c1-13-4-2-3-8(12-11)7-5-9(10)14-6-7/h5-6,8,12H,2-4,11H2,1H3
InChIKeyXEYPFYWMMGMYDE-UHFFFAOYSA-N
XLogP2.44
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.20
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(5-bromothiophen-3-yl)-4-methoxybutan-1-ol
CID 105132747
[1-(2,5-dibromothiophen-3-yl)-4-methoxybutyl]hydrazine
CID 107970665
[1-(5-bromothiophen-3-yl)-3-methylhexyl]hydrazine
CID 105298248
[1-(3,4-dimethylphenyl)-4-methoxybutyl]hydrazine
CID 105225093
1-(5-bromothiophen-3-yl)pent-3-ynylhydrazine
CID 105290740
[1-(5-bromothiophen-3-yl)-3-ethylheptyl]hydrazine
CID 105288393
(4-methoxy-1-pyridin-3-ylbutyl)hydrazine
CID 105196232
1-(5-bromothiophen-3-yl)but-3-ynylhydrazine
CID 105281586
[1-(5-bromothiophen-3-yl)-3-thiophen-3-ylpropyl]hydrazine
CID 105306858
[4-methoxy-1-(4-methoxy-3-methylphenyl)butyl]hydrazine
CID 105258430
[1-(5-bromothiophen-3-yl)-3-(1-methylimidazol-2-yl)propyl]hydrazine
CID 105340409
[1-(4-bromo-2-methoxyphenyl)-4-methoxybutyl]hydrazine
CID 105342619

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine?
The IUPAC name of [1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine (CID 105342588) is [1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine.
What is the SMILES notation for [1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine?
The canonical SMILES for [1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine is COCCCC(NN)c1csc(Br)c1.
What is the InChIKey of [1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine?
The InChIKey is XEYPFYWMMGMYDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15BrN2OS/c1-13-4-2-3-8(12-11)7-5-9(10)14-6-7/h5-6,8,12H,2-4,11H2,1H3.
What are the key properties of [1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine?
[1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine has a molecular weight of 279.20 g/mol, XLogP of 2.44, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromothiophen-3-yl)-4-methoxybutyl]hydrazine is sourced from PubChem (CID 105342588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).