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

C15H19BrN2OS — CID 105299378

IUPAC[2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine
SMILESCCCOc1cccc(C(Cc2cc(Br)cs2)NN)c1
InChIInChI=1S/C15H19BrN2OS/c1-2-6-19-13-5-3-4-11(7-13)15(18-17)9-14-8-12(16)10-20-14/h3-5,7-8,10,15,18H,2,6,9,17H2,1H3
InChIKeyQSMLKUKANNBFEO-UHFFFAOYSA-N
MW355.30 g/mol
LogP4.05
Rot. Bonds7

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

[2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine (PubChem CID 105299378) has the molecular formula C15H19BrN2OS and a molecular weight of 355.30 g/mol. Its IUPAC name is [2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine
PubChem CID105299378
Molecular FormulaC15H19BrN2OS
Molecular Weight355.30 g/mol
Exact Mass354.04
IUPAC Name[2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine
SMILESCCCOc1cccc(C(Cc2cc(Br)cs2)NN)c1
InChIInChI=1S/C15H19BrN2OS/c1-2-6-19-13-5-3-4-11(7-13)15(18-17)9-14-8-12(16)10-20-14/h3-5,7-8,10,15,18H,2,6,9,17H2,1H3
InChIKeyQSMLKUKANNBFEO-UHFFFAOYSA-N
XLogP4.05
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.30
LogP ≤ 54.05
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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Related Compounds

[2-(4-bromothiophen-2-yl)-1-(3-fluorophenyl)ethyl]hydrazine
CID 105193124
[2-(5-bromo-3-pyridinyl)-1-(3-propoxyphenyl)ethyl]hydrazine
CID 105334826
[3-methyl-1-(3-propoxyphenyl)butyl]hydrazine
CID 105282817
[2-(4-iodophenyl)-1-(3-propoxyphenyl)ethyl]hydrazine
CID 105310368
2-(4-bromothiophen-2-yl)-1-(4-propoxyphenyl)ethanol
CID 65146016
[2-propan-2-yloxy-1-(3-propoxyphenyl)ethyl]hydrazine
CID 105323803
[2-(4-bromophenyl)-1-(3-ethoxyphenyl)ethyl]hydrazine
CID 105192046
2-(5-ethylthiophen-2-yl)-N-methyl-1-(3-propoxyphenyl)ethanamine
CID 115842505
[2-(4-bromothiophen-2-yl)-1-(2-methoxyphenyl)ethyl]hydrazine
CID 105191242
[2-(4-bromothiophen-2-yl)-1-(3-ethylthiophen-2-yl)ethyl]hydrazine
CID 105299228
1-(3-propoxyphenyl)prop-2-ynylhydrazine
CID 105315638
N-methyl-1-(3-propoxyphenyl)propan-1-amine
CID 114979549

Frequently Asked Questions

What is the IUPAC name of [2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine?
The IUPAC name of [2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine (CID 105299378) is [2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine is CCCOc1cccc(C(Cc2cc(Br)cs2)NN)c1.
What is the InChIKey of [2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine?
The InChIKey is QSMLKUKANNBFEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19BrN2OS/c1-2-6-19-13-5-3-4-11(7-13)15(18-17)9-14-8-12(16)10-20-14/h3-5,7-8,10,15,18H,2,6,9,17H2,1H3.
What are the key properties of [2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine?
[2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine has a molecular weight of 355.30 g/mol, XLogP of 4.05, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine is sourced from PubChem (CID 105299378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).