[2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine

C13H22BrN3OS — CID 105247768

IUPAC[2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine
SMILESCCCN1CCOC(C(Cc2ccc(Br)s2)NN)C1
InChIInChI=1S/C13H22BrN3OS/c1-2-5-17-6-7-18-12(9-17)11(16-15)8-10-3-4-13(14)19-10/h3-4,11-12,16H,2,5-9,15H2,1H3
InChIKeyZEQMVKXHUUOOLB-UHFFFAOYSA-N
MW348.31 g/mol
LogP2.00
Rot. Bonds6

About [2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine

[2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine (PubChem CID 105247768) has the molecular formula C13H22BrN3OS and a molecular weight of 348.31 g/mol. Its IUPAC name is [2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine
PubChem CID105247768
Molecular FormulaC13H22BrN3OS
Molecular Weight348.31 g/mol
Exact Mass347.07
IUPAC Name[2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine
SMILESCCCN1CCOC(C(Cc2ccc(Br)s2)NN)C1
InChIInChI=1S/C13H22BrN3OS/c1-2-5-17-6-7-18-12(9-17)11(16-15)8-10-3-4-13(14)19-10/h3-4,11-12,16H,2,5-9,15H2,1H3
InChIKeyZEQMVKXHUUOOLB-UHFFFAOYSA-N
XLogP2.00
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.31
LogP ≤ 52.00
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-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine (CID 105247768) is [2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine is CCCN1CCOC(C(Cc2ccc(Br)s2)NN)C1.
What is the InChIKey of [2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine?
The InChIKey is ZEQMVKXHUUOOLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22BrN3OS/c1-2-5-17-6-7-18-12(9-17)11(16-15)8-10-3-4-13(14)19-10/h3-4,11-12,16H,2,5-9,15H2,1H3.
What are the key properties of [2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine?
[2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine has a molecular weight of 348.31 g/mol, XLogP of 2.00, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-bromothiophen-2-yl)-1-(4-propylmorpholin-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105247768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).