[1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine

C6H6BrF3N2S — CID 105215838

IUPAC[1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine
SMILESNNC(c1sccc1Br)C(F)(F)F
InChIInChI=1S/C6H6BrF3N2S/c7-3-1-2-13-4(3)5(12-11)6(8,9)10/h1-2,5,12H,11H2
InChIKeyMQNBYSJDXFGLPT-UHFFFAOYSA-N
MW275.09 g/mol
LogP2.58
Rot. Bonds2

About [1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine

[1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine (PubChem CID 105215838) has the molecular formula C6H6BrF3N2S and a molecular weight of 275.09 g/mol. Its IUPAC name is [1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine
PubChem CID105215838
Molecular FormulaC6H6BrF3N2S
Molecular Weight275.09 g/mol
Exact Mass273.94
IUPAC Name[1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine
SMILESNNC(c1sccc1Br)C(F)(F)F
InChIInChI=1S/C6H6BrF3N2S/c7-3-1-2-13-4(3)5(12-11)6(8,9)10/h1-2,5,12H,11H2
InChIKeyMQNBYSJDXFGLPT-UHFFFAOYSA-N
XLogP2.58
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.09
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

1-(3-bromothiophen-2-yl)-2,2,2-trifluoro-N-methylethanamine
CID 79016591
1-(3-bromothiophen-2-yl)-1-hydrazinyl-N,N,2-trimethylpropan-2-amine
CID 105239110
[1-(3-bromothiophen-2-yl)-3,3,3-trifluoropropyl]hydrazine
CID 105206154
[1-(3-bromothiophen-2-yl)-2,2-difluoroethyl]hydrazine
CID 105265250
(1S)-1-(3-bromothiophen-2-yl)-2,2,3,3,3-pentafluoropropan-1-amine
CID 131352754
[1-(3-bromothiophen-2-yl)-2-tert-butylsulfanylethyl]hydrazine
CID 105226600
[1-(3-bromothiophen-2-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151632
1-(3-bromothiophen-2-yl)-2,2,3,3-tetrafluoro-N-propylpropan-1-amine
CID 80535785
[(3-bromothiophen-2-yl)-(3,4,5-trifluorophenyl)methyl]hydrazine
CID 105208216
[1-(3-bromothiophen-2-yl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105235170
[2-chloro-2,2-difluoro-1-(3-methylthiophen-2-yl)ethyl]hydrazine
CID 105265504
1,2-bis(3-bromothiophen-2-yl)ethylhydrazine
CID 105299585

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine?
The IUPAC name of [1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine (CID 105215838) is [1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine.
What is the SMILES notation for [1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine?
The canonical SMILES for [1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine is NNC(c1sccc1Br)C(F)(F)F.
What is the InChIKey of [1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine?
The InChIKey is MQNBYSJDXFGLPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6BrF3N2S/c7-3-1-2-13-4(3)5(12-11)6(8,9)10/h1-2,5,12H,11H2.
What are the key properties of [1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine?
[1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine has a molecular weight of 275.09 g/mol, XLogP of 2.58, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromothiophen-2-yl)-2,2,2-trifluoroethyl]hydrazine is sourced from PubChem (CID 105215838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).