2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine

C8H14BrN3S — CID 83011912

IUPAC2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine
SMILESCN(C)NC(CN)c1sccc1Br
InChIInChI=1S/C8H14BrN3S/c1-12(2)11-7(5-10)8-6(9)3-4-13-8/h3-4,7,11H,5,10H2,1-2H3
InChIKeyXCAGHSICPXADEN-UHFFFAOYSA-N
MW264.19 g/mol
LogP1.58
Rot. Bonds4

About 2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine

2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine (PubChem CID 83011912) has the molecular formula C8H14BrN3S and a molecular weight of 264.19 g/mol. Its IUPAC name is 2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine.

Molecular Properties

Compound Name2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine
PubChem CID83011912
Molecular FormulaC8H14BrN3S
Molecular Weight264.19 g/mol
Exact Mass263.01
IUPAC Name2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine
SMILESCN(C)NC(CN)c1sccc1Br
InChIInChI=1S/C8H14BrN3S/c1-12(2)11-7(5-10)8-6(9)3-4-13-8/h3-4,7,11H,5,10H2,1-2H3
InChIKeyXCAGHSICPXADEN-UHFFFAOYSA-N
XLogP1.58
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.19
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(4-bromophenyl)-1-(3-bromothiophen-2-yl)ethane-1,2-diamine
CID 113298104
2-(2,2-dimethylhydrazinyl)-2-thiophen-2-ylethanamine
CID 83011900
1-(3-bromothiophen-2-yl)-N-(cyclopropylmethyl)ethane-1,2-diamine
CID 115380480
2-(3-bromothiophen-2-yl)-2-[2-(dimethylamino)ethylamino]ethanol
CID 115381058
1-(3-bromothiophen-2-yl)-N,N-diethylethane-1,2-diamine
CID 115380264
1-(3-bromothiophen-2-yl)-N-methyl-N-(2-methylsulfonylethyl)ethane-1,2-diamine
CID 115380506
[1-(3-bromothiophen-2-yl)-2-tert-butylsulfanylethyl]hydrazine
CID 105226600
2-(3-bromothiophen-2-yl)-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine
CID 115380421
1-(3-bromothiophen-2-yl)-N-butan-2-yl-N-butylethane-1,2-diamine
CID 115380378
1-(3-bromothiophen-2-yl)-1-hydrazinyl-N,N,2-trimethylpropan-2-amine
CID 105239110
1-(3-bromothiophen-2-yl)-N-methyloctan-1-amine
CID 80534752
1-(3-bromothiophen-2-yl)-N-(3,5-dimethylphenyl)-N-methylethane-1,2-diamine
CID 115380401

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine?
The IUPAC name of 2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine (CID 83011912) is 2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine.
What is the SMILES notation for 2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine?
The canonical SMILES for 2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine is CN(C)NC(CN)c1sccc1Br.
What is the InChIKey of 2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine?
The InChIKey is XCAGHSICPXADEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14BrN3S/c1-12(2)11-7(5-10)8-6(9)3-4-13-8/h3-4,7,11H,5,10H2,1-2H3.
What are the key properties of 2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine?
2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine has a molecular weight of 264.19 g/mol, XLogP of 1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromothiophen-2-yl)-2-(2,2-dimethylhydrazinyl)ethanamine is sourced from PubChem (CID 83011912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).