5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine

C6H5ClF3NS — CID 115257639

IUPAC5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine
SMILESFC(F)(F)CNc1ccc(Cl)s1
InChIInChI=1S/C6H5ClF3NS/c7-4-1-2-5(12-4)11-3-6(8,9)10/h1-2,11H,3H2
InChIKeyVUUWUZIZIOANRG-UHFFFAOYSA-N
MW215.63 g/mol
LogP3.38
Rot. Bonds2

About 5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine

5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine (PubChem CID 115257639) has the molecular formula C6H5ClF3NS and a molecular weight of 215.63 g/mol. Its IUPAC name is 5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine.

Molecular Properties

Compound Name5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine
PubChem CID115257639
Molecular FormulaC6H5ClF3NS
Molecular Weight215.63 g/mol
Exact Mass214.98
IUPAC Name5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine
SMILESFC(F)(F)CNc1ccc(Cl)s1
InChIInChI=1S/C6H5ClF3NS/c7-4-1-2-5(12-4)11-3-6(8,9)10/h1-2,11H,3H2
InChIKeyVUUWUZIZIOANRG-UHFFFAOYSA-N
XLogP3.38
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.63
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-Chlorothiophen-2-yl)-2-(trifluoromethyl)piperazine
CID 115101318
1-(5-Chlorothiophen-2-yl)-2-(trifluoromethyl)-1,4-diazepane
CID 115101703
N-(5-chlorothiophen-2-yl)-2,2,2-trifluoroacetamide
CID 115190102
N-(2,2,2-trifluoroethyl)thiophen-2-amine
CID 115257628
5-chloro-N-methyl-N-(2,2,2-trifluoroethyl)thiophen-2-amine
CID 115257746
1-(5-Chlorothiophen-2-yl)piperazine
CID 17912210
4-chloro-N-propan-2-ylthiophen-2-amine
CID 19031749
5-chloro-N-methylthiophen-2-amine
CID 66829073
5-chloro-N-ethyl-N-methylthiophen-2-amine
CID 67755029
N'-(5-chlorothiophen-2-yl)ethane-1,2-diamine
CID 80279561
5-chloro-N-propan-2-ylthiophen-2-amine
CID 83529681
N-(5-chlorothiophen-2-yl)formamide
CID 87756625

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine?
The IUPAC name of 5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine (CID 115257639) is 5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine.
What is the SMILES notation for 5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine?
The canonical SMILES for 5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine is FC(F)(F)CNc1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine?
The InChIKey is VUUWUZIZIOANRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5ClF3NS/c7-4-1-2-5(12-4)11-3-6(8,9)10/h1-2,11H,3H2.
What are the key properties of 5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine?
5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine has a molecular weight of 215.63 g/mol, XLogP of 3.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,2,2-trifluoroethyl)thiophen-2-amine is sourced from PubChem (CID 115257639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).