3-bromo-2-chloro-5-(trifluoromethyl)pyrazine

C5HBrClF3N2 — CID 130116239

IUPAC3-bromo-2-chloro-5-(trifluoromethyl)pyrazine
SMILESFC(F)(F)c1cnc(Cl)c(Br)n1
InChIInChI=1S/C5HBrClF3N2/c6-3-4(7)11-1-2(12-3)5(8,9)10/h1H
InChIKeyIZIACMBFKWHLCD-UHFFFAOYSA-N
MW261.43 g/mol
LogP2.91
Rot. Bonds

About 3-bromo-2-chloro-5-(trifluoromethyl)pyrazine

3-bromo-2-chloro-5-(trifluoromethyl)pyrazine (PubChem CID 130116239) has the molecular formula C5HBrClF3N2 and a molecular weight of 261.43 g/mol. Its IUPAC name is 3-bromo-2-chloro-5-(trifluoromethyl)pyrazine.

Molecular Properties

Compound Name3-bromo-2-chloro-5-(trifluoromethyl)pyrazine
PubChem CID130116239
Molecular FormulaC5HBrClF3N2
Molecular Weight261.43 g/mol
Exact Mass259.90
IUPAC Name3-bromo-2-chloro-5-(trifluoromethyl)pyrazine
SMILESFC(F)(F)c1cnc(Cl)c(Br)n1
InChIInChI=1S/C5HBrClF3N2/c6-3-4(7)11-1-2(12-3)5(8,9)10/h1H
InChIKeyIZIACMBFKWHLCD-UHFFFAOYSA-N
XLogP2.91
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.43
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-4-chloro-5-(trifluoromethyl)pyrimidine
CID 118991334
2-bromo-3-chloro-4-(difluoromethyl)-6-(trifluoromethyl)pyridine
CID 118995680
2-chloro-5-(trifluoromethyl)pyrazine;ethane
CID 144826305
[5-chloro-6-(trifluoromethyl)pyrazin-2-yl]methanamine
CID 83848889
2-bromo-3-chloro-5-(trifluoromethyl)pyridine
CID 2736237
5-(trifluoromethyl)pyrazine-2,3-dicarbonitrile
CID 10987216
2-(4-bromophenyl)-4-chloro-6-(trifluoromethyl)pyrimidine
CID 91620563
(5-bromo-3-pyridinyl)-[2-chloro-6-(trifluoromethyl)-3-pyridinyl]methanone
CID 106971979
3,6-bis(trifluoromethyl)-1,2,4-triazine
CID 170294965
6-bromo-3-(trifluoromethyl)isoquinoline
CID 154827809
3,5-dibromo-2-chloro-6-(trifluoromethyl)pyridine
CID 124849965
3-bromo-2,4-dichloro-5-(trifluoromethoxy)pyridine
CID 130093759

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-chloro-5-(trifluoromethyl)pyrazine?
The IUPAC name of 3-bromo-2-chloro-5-(trifluoromethyl)pyrazine (CID 130116239) is 3-bromo-2-chloro-5-(trifluoromethyl)pyrazine.
What is the SMILES notation for 3-bromo-2-chloro-5-(trifluoromethyl)pyrazine?
The canonical SMILES for 3-bromo-2-chloro-5-(trifluoromethyl)pyrazine is FC(F)(F)c1cnc(Cl)c(Br)n1.
What is the InChIKey of 3-bromo-2-chloro-5-(trifluoromethyl)pyrazine?
The InChIKey is IZIACMBFKWHLCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5HBrClF3N2/c6-3-4(7)11-1-2(12-3)5(8,9)10/h1H.
What are the key properties of 3-bromo-2-chloro-5-(trifluoromethyl)pyrazine?
3-bromo-2-chloro-5-(trifluoromethyl)pyrazine has a molecular weight of 261.43 g/mol, XLogP of 2.91, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-chloro-5-(trifluoromethyl)pyrazine is sourced from PubChem (CID 130116239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).