[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone

C26H15F4N3O2 — CID 21027433

IUPAC[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone
SMILESO=C(c1ccccc1OC(F)(F)F)c1cccc2c(-c3ccncc3)c(-c3ccc(F)cc3)nn12
InChIInChI=1S/C26H15F4N3O2/c27-18-10-8-17(9-11-18)24-23(16-12-14-31-15-13-16)20-5-3-6-21(33(20)32-24)25(34)19-4-1-2-7-22(19)35-26(28,29)30/h1-15H
InChIKeyWJFVRYGZTJLUGC-UHFFFAOYSA-N
MW477.42 g/mol
LogP6.33
Rot. Bonds5

About [2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone

[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone (PubChem CID 21027433) has the molecular formula C26H15F4N3O2 and a molecular weight of 477.42 g/mol. Its IUPAC name is [2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone.

Molecular Properties

Compound Name[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone
PubChem CID21027433
Molecular FormulaC26H15F4N3O2
Molecular Weight477.42 g/mol
Exact Mass477.11
IUPAC Name[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone
SMILESO=C(c1ccccc1OC(F)(F)F)c1cccc2c(-c3ccncc3)c(-c3ccc(F)cc3)nn12
InChIInChI=1S/C26H15F4N3O2/c27-18-10-8-17(9-11-18)24-23(16-12-14-31-15-13-16)20-5-3-6-21(33(20)32-24)25(34)19-4-1-2-7-22(19)35-26(28,29)30/h1-15H
InChIKeyWJFVRYGZTJLUGC-UHFFFAOYSA-N
XLogP6.33
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500477.42
LogP ≤ 56.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(7-Methoxy-2-trifluoromethylpyrazolo[1,5-a]pyridin-4-yl)-2-(pyridin-4-yl)ethanone
CID 24798271
6-[(6-Methoxy-2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid
CID 60151149
(E)-1-(2,5-dimethoxyphenyl)-3-(1-phenyl-3-pyridin-4-ylpyrazol-4-yl)prop-2-en-1-one
CID 9028330
(E)-1-(2,5-dimethoxyphenyl)-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-en-1-one
CID 40606425
[7-Methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]-pyridin-4-ylmethanone
CID 72193177
1-[7-Methoxy-2-(trifluoromethyl)pyrazolo[1,5-a]pyridin-4-yl]-2-pyridin-4-ylethane-1,2-dione
CID 72193176
[1-[2-(4-Fluorophenyl)ethyl]-3-pyridin-2-ylpyrazol-5-yl]-(2-methoxyphenyl)methanone
CID 172466773
{5-[1-(2-Methoxybenzoyl)-4-piperidyl]pyrazolo[1,5-a]pyridin-3-yl}(1-pyrrolidinyl)methanone
CID 50848433
{5-[1-(2-Methoxybenzoyl)-4-piperidyl]pyrazolo[1,5-a]pyridin-3-yl}(piperidino)methanone
CID 50848907
[4-[1-[(3-Fluorophenyl)methyl]indol-3-yl]piperidin-1-yl]-[2-(trifluoromethoxy)phenyl]methanone
CID 46089990
[2-(4-Fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-(furan-2-yl)methanone
CID 10156783
[2-(4-Fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]methyl 2-methoxybenzoate
CID 10297820

Frequently Asked Questions

What is the IUPAC name of [2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone?
The IUPAC name of [2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone (CID 21027433) is [2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone.
What is the SMILES notation for [2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone?
The canonical SMILES for [2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone is O=C(c1ccccc1OC(F)(F)F)c1cccc2c(-c3ccncc3)c(-c3ccc(F)cc3)nn12.
What is the InChIKey of [2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone?
The InChIKey is WJFVRYGZTJLUGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H15F4N3O2/c27-18-10-8-17(9-11-18)24-23(16-12-14-31-15-13-16)20-5-3-6-21(33(20)32-24)25(34)19-4-1-2-7-22(19)35-26(28,29)30/h1-15H.
What are the key properties of [2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone?
[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone has a molecular weight of 477.42 g/mol, XLogP of 6.33, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]-[2-(trifluoromethoxy)phenyl]methanone is sourced from PubChem (CID 21027433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).