3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine

C14H7BrF4N2 — CID 11337308

IUPAC3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine
SMILESFc1ccc(-c2nn3cc(C(F)(F)F)ccc3c2Br)cc1
InChIInChI=1S/C14H7BrF4N2/c15-12-11-6-3-9(14(17,18)19)7-21(11)20-13(12)8-1-4-10(16)5-2-8/h1-7H
InChIKeyMVCVSYBUVYJMHN-UHFFFAOYSA-N
MW359.12 g/mol
LogP4.92
Rot. Bonds1

About 3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine

3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine (PubChem CID 11337308) has the molecular formula C14H7BrF4N2 and a molecular weight of 359.12 g/mol. Its IUPAC name is 3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine
PubChem CID11337308
Molecular FormulaC14H7BrF4N2
Molecular Weight359.12 g/mol
Exact Mass357.97
IUPAC Name3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine
SMILESFc1ccc(-c2nn3cc(C(F)(F)F)ccc3c2Br)cc1
InChIInChI=1S/C14H7BrF4N2/c15-12-11-6-3-9(14(17,18)19)7-21(11)20-13(12)8-1-4-10(16)5-2-8/h1-7H
InChIKeyMVCVSYBUVYJMHN-UHFFFAOYSA-N
XLogP4.92
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.12
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-Fluorophenyl)-6-methyl-3-(pyridin-4-yl)pyrazolo[1,5-a]pyridine
CID 9814925
2-(4-Fluorophenyl)-3-(4-pyridinyl)pyrazolo[1,5-a]pyridine
CID 9857146
6-Fluoro-2-(4-fluorophenyl)-3-(pyridin-4-yl)pyrazolo[1,5-a]pyridine
CID 9944397
2-(4-Fluorophenyl)-5-methyl-3-(pyridin-4-yl)pyrazolo[1,5-a]pyridine
CID 9836050
2-(4-Fluorophenyl)-7-methyl-3-(pyridin-4-yl)pyrazolo[1,5-a]pyridine
CID 9836051
2-(4-Fluorophenyl)-4-methyl-3-(pyridin-4-yl)pyrazolo[1,5-a]pyridine
CID 9879492
4-Fluoro-2-(4-fluorophenyl)-3-(pyridin-4-yl)pyrazolo[1,5-a]pyridine
CID 9879605
2-(4-Fluorophenyl)-3-(pyridin-4-yl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine
CID 10155254
4-[3-(4-Fluorophenyl)-1-methyl-1h-pyrazol-4-yl]pyridine
CID 22037373
5-Fluoro-1-(5-fluoro-3-pyridinyl)indazole
CID 90252839
5-Fluoro-1-[5-(trifluoromethyl)pyridin-3-yl]indazole
CID 90252954
1-methyl-3-phenyl-6-(trifluoromethyl)-1H-pyrazolo[4,3-b]pyridine
CID 1480373

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The IUPAC name of 3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine (CID 11337308) is 3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The canonical SMILES for 3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine is Fc1ccc(-c2nn3cc(C(F)(F)F)ccc3c2Br)cc1.
What is the InChIKey of 3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The InChIKey is MVCVSYBUVYJMHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H7BrF4N2/c15-12-11-6-3-9(14(17,18)19)7-21(11)20-13(12)8-1-4-10(16)5-2-8/h1-7H.
What are the key properties of 3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine has a molecular weight of 359.12 g/mol, XLogP of 4.92, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-(4-fluorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 11337308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).