5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine

C9H5BrF3N3 — CID 84814969

IUPAC5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine
SMILESFC(F)(F)c1ccnn1-c1ccc(Br)cn1
InChIInChI=1S/C9H5BrF3N3/c10-6-1-2-8(14-5-6)16-7(3-4-15-16)9(11,12)13/h1-5H
InChIKeyZEIPUDBQXVKXSW-UHFFFAOYSA-N
MW292.06 g/mol
LogP3.05
Rot. Bonds1

About 5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine

5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine (PubChem CID 84814969) has the molecular formula C9H5BrF3N3 and a molecular weight of 292.06 g/mol. Its IUPAC name is 5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine.

Molecular Properties

Compound Name5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine
PubChem CID84814969
Molecular FormulaC9H5BrF3N3
Molecular Weight292.06 g/mol
Exact Mass290.96
IUPAC Name5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine
SMILESFC(F)(F)c1ccnn1-c1ccc(Br)cn1
InChIInChI=1S/C9H5BrF3N3/c10-6-1-2-8(14-5-6)16-7(3-4-15-16)9(11,12)13/h1-5H
InChIKeyZEIPUDBQXVKXSW-UHFFFAOYSA-N
XLogP3.05
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.06
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-bromo-2-pyridinyl)pyrazol-3-amine
CID 65347835
5-bromo-2-[4-(bromomethyl)-5-(trifluoromethyl)pyrazol-1-yl]pyridine
CID 66439480
1-(2,6-dibromophenyl)-5-(trifluoromethyl)pyrazole
CID 91350920
[2-(5-bromo-2-pyridinyl)pyrazol-3-yl] carbamate
CID 175326367
1-[1-(5-bromo-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]-N-methylmethanamine
CID 66442611
5-bromo-2-[4-(2,2,2-trifluoroethoxy)pyrazol-1-yl]pyridine
CID 166174831
1-(5-bromo-2-pyridinyl)-5-chloro-3-(trifluoromethyl)pyrazole-4-carbaldehyde
CID 65348183
[1-(5-bromo-2-pyridinyl)-5-chloro-3-(trifluoromethyl)pyrazol-4-yl]methanol
CID 65349562
5-chloro-3-fluoro-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine
CID 141290024
4,5-dibromo-2-(5-bromo-2-pyridinyl)pyridazin-3-one
CID 65347944
1-(5-bromo-2-pyridinyl)-3-(trifluoromethyl)azetidin-3-ol
CID 162745565
5-bromo-2-(2,5-dihydropyrrol-1-yl)pyridine
CID 23438624

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine?
The IUPAC name of 5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine (CID 84814969) is 5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine.
What is the SMILES notation for 5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine?
The canonical SMILES for 5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine is FC(F)(F)c1ccnn1-c1ccc(Br)cn1.
What is the InChIKey of 5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine?
The InChIKey is ZEIPUDBQXVKXSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5BrF3N3/c10-6-1-2-8(14-5-6)16-7(3-4-15-16)9(11,12)13/h1-5H.
What are the key properties of 5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine?
5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine has a molecular weight of 292.06 g/mol, XLogP of 3.05, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-[5-(trifluoromethyl)pyrazol-1-yl]pyridine is sourced from PubChem (CID 84814969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).