3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine

C15H9F4N3 — CID 141414913

IUPAC3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine
SMILESFc1cc(-c2ccccc2)cnc1-n1ccc(C(F)(F)F)n1
InChIInChI=1S/C15H9F4N3/c16-12-8-11(10-4-2-1-3-5-10)9-20-14(12)22-7-6-13(21-22)15(17,18)19/h1-9H
InChIKeyXMTICGJMTRAVCW-UHFFFAOYSA-N
MW307.25 g/mol
LogP4.09
Rot. Bonds2

About 3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine

3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine (PubChem CID 141414913) has the molecular formula C15H9F4N3 and a molecular weight of 307.25 g/mol. Its IUPAC name is 3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine.

Molecular Properties

Compound Name3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine
PubChem CID141414913
Molecular FormulaC15H9F4N3
Molecular Weight307.25 g/mol
Exact Mass307.07
IUPAC Name3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine
SMILESFc1cc(-c2ccccc2)cnc1-n1ccc(C(F)(F)F)n1
InChIInChI=1S/C15H9F4N3/c16-12-8-11(10-4-2-1-3-5-10)9-20-14(12)22-7-6-13(21-22)15(17,18)19/h1-9H
InChIKeyXMTICGJMTRAVCW-UHFFFAOYSA-N
XLogP4.09
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.25
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-5-chloro-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine
CID 114837465
1-(3-fluorophenyl)-3-(trifluoromethyl)pyrazole
CID 66016332
3-(trifluoromethyl)-1-(3,4,5-trifluorophenyl)pyrazole
CID 79194874
[5-fluoro-4-[3-(trifluoromethyl)pyrazol-1-yl]pyrimidin-2-yl]hydrazine
CID 80899957
5-methyl-6-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-carbaldehyde
CID 80631834
2-fluoro-5-phenyl-3-(trifluoromethyl)pyridine
CID 133094917
1-(4-bromo-2,6-difluorophenyl)-3-(trifluoromethyl)pyrazole
CID 86707216
5-fluoro-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine
CID 177229961
2,5-dichloro-4-[3-(trifluoromethyl)pyrazol-1-yl]pyrimidine
CID 79633439
3-fluoro-2-iodo-5-phenylpyridine
CID 130902432
1-[5-bromo-2-[3-(trifluoromethyl)pyrazol-1-yl]-3-pyridinyl]-N-methylmethanamine
CID 55059422
1-chloro-4-[3-(trifluoromethyl)pyrazol-1-yl]phthalazine
CID 62140435

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine?
The IUPAC name of 3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine (CID 141414913) is 3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine.
What is the SMILES notation for 3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine?
The canonical SMILES for 3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine is Fc1cc(-c2ccccc2)cnc1-n1ccc(C(F)(F)F)n1.
What is the InChIKey of 3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine?
The InChIKey is XMTICGJMTRAVCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9F4N3/c16-12-8-11(10-4-2-1-3-5-10)9-20-14(12)22-7-6-13(21-22)15(17,18)19/h1-9H.
What are the key properties of 3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine?
3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine has a molecular weight of 307.25 g/mol, XLogP of 4.09, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine is sourced from PubChem (CID 141414913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).