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

C11H18BrN3S2 — CID 106446358

IUPAC[2-(3-bromothiophen-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
SMILESCN1CCSCC1C(Cc1sccc1Br)NN
InChIInChI=1S/C11H18BrN3S2/c1-15-3-5-16-7-10(15)9(14-13)6-11-8(12)2-4-17-11/h2,4,9-10,14H,3,5-7,13H2,1H3
InChIKeyXPFOGEUZHKTACE-UHFFFAOYSA-N
MW336.32 g/mol
LogP1.93
Rot. Bonds4

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

[2-(3-bromothiophen-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine (PubChem CID 106446358) has the molecular formula C11H18BrN3S2 and a molecular weight of 336.32 g/mol. Its IUPAC name is [2-(3-bromothiophen-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3-bromothiophen-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
PubChem CID106446358
Molecular FormulaC11H18BrN3S2
Molecular Weight336.32 g/mol
Exact Mass335.01
IUPAC Name[2-(3-bromothiophen-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
SMILESCN1CCSCC1C(Cc1sccc1Br)NN
InChIInChI=1S/C11H18BrN3S2/c1-15-3-5-16-7-10(15)9(14-13)6-11-8(12)2-4-17-11/h2,4,9-10,14H,3,5-7,13H2,1H3
InChIKeyXPFOGEUZHKTACE-UHFFFAOYSA-N
XLogP1.93
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.32
LogP ≤ 51.93
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

[2-(3-bromothiophen-2-yl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine
CID 105247367
[1-(4-methylthiomorpholin-3-yl)-2-phenylethyl]hydrazine
CID 106446350
[2-(4-ethylphenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446480
[2-(3-bromothiophen-2-yl)-1-(1,4-oxathian-2-yl)ethyl]hydrazine
CID 105249733
[2-(5-bromo-2-methoxyphenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446415
[2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446251
[2-(1-methylimidazol-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446326
3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine
CID 106446527
[2-(2-chloro-5-fluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446395
[2-(5-ethyl-2-pyridinyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446379
2-(3-bromothiophen-2-yl)-N-methyl-1-(thiolan-3-yl)ethanamine
CID 105139532
[2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446450

Frequently Asked Questions

What is the IUPAC name of [2-(3-bromothiophen-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(3-bromothiophen-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine (CID 106446358) is [2-(3-bromothiophen-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(3-bromothiophen-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(3-bromothiophen-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine is CN1CCSCC1C(Cc1sccc1Br)NN.
What is the InChIKey of [2-(3-bromothiophen-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine?
The InChIKey is XPFOGEUZHKTACE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18BrN3S2/c1-15-3-5-16-7-10(15)9(14-13)6-11-8(12)2-4-17-11/h2,4,9-10,14H,3,5-7,13H2,1H3.
What are the key properties of [2-(3-bromothiophen-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine?
[2-(3-bromothiophen-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine has a molecular weight of 336.32 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-bromothiophen-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine is sourced from PubChem (CID 106446358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).