5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine

C10H6BrF3N2S — CID 25093334

IUPAC5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine
SMILESFC(F)(F)c1ccccc1Nc1ncc(Br)s1
InChIInChI=1S/C10H6BrF3N2S/c11-8-5-15-9(17-8)16-7-4-2-1-3-6(7)10(12,13)14/h1-5H,(H,15,16)
InChIKeyXLHGMJDJMQBVOQ-UHFFFAOYSA-N
MW323.14 g/mol
LogP4.67
Rot. Bonds2

About 5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine

5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine (PubChem CID 25093334) has the molecular formula C10H6BrF3N2S and a molecular weight of 323.14 g/mol. Its IUPAC name is 5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine
PubChem CID25093334
Molecular FormulaC10H6BrF3N2S
Molecular Weight323.14 g/mol
Exact Mass321.94
IUPAC Name5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine
SMILESFC(F)(F)c1ccccc1Nc1ncc(Br)s1
InChIInChI=1S/C10H6BrF3N2S/c11-8-5-15-9(17-8)16-7-4-2-1-3-6(7)10(12,13)14/h1-5H,(H,15,16)
InChIKeyXLHGMJDJMQBVOQ-UHFFFAOYSA-N
XLogP4.67
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.14
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,5-Diphenyl-1,3-thiazol-2-amine
CID 619921
5-bromo-N-phenyl-1,3-thiazol-2-amine
CID 12348630
Thiourea, N-(2-(2-azidophenyl)ethyl)-N'-2-thiazolyl-
CID 3001168
5-bromo-N-(4-fluorophenyl)-1,3-thiazol-2-amine
CID 16068845
N-(4-fluorophenyl)-5-iodo-1,3-thiazol-2-amine
CID 16068846
5-bromo-N-(3-fluorophenyl)-1,3-thiazol-2-amine
CID 16068637
5-bromo-N-[4-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine
CID 16068740
5-bromo-N-(2-fluorophenyl)-1,3-thiazol-2-amine
CID 16068850
(5-Chloro-thiazol-2-yl)-(4-fluoro-phenyl)-amine
CID 16095351
1-N-(5-bromo-1,3-thiazol-2-yl)benzene-1,4-diamine
CID 16068735
5-bromo-N-[3-(methylsulfanyl)phenyl]-1,3-thiazol-2-amine
CID 16068852
Stk034174
CID 773605

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine?
The IUPAC name of 5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine (CID 25093334) is 5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine?
The canonical SMILES for 5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine is FC(F)(F)c1ccccc1Nc1ncc(Br)s1.
What is the InChIKey of 5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine?
The InChIKey is XLHGMJDJMQBVOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrF3N2S/c11-8-5-15-9(17-8)16-7-4-2-1-3-6(7)10(12,13)14/h1-5H,(H,15,16).
What are the key properties of 5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine?
5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine has a molecular weight of 323.14 g/mol, XLogP of 4.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 25093334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).