(4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone

C25H14F3N3O — CID 21027393

IUPAC(4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone
SMILESO=C(c1ccc(F)cc1)c1cccc2c(-c3ccnc(F)c3)c(-c3ccc(F)cc3)nn12
InChIInChI=1S/C25H14F3N3O/c26-18-8-4-15(5-9-18)24-23(17-12-13-29-22(28)14-17)20-2-1-3-21(31(20)30-24)25(32)16-6-10-19(27)11-7-16/h1-14H
InChIKeyXIJWUGBJVTWFPG-UHFFFAOYSA-N
MW429.40 g/mol
LogP5.71
Rot. Bonds4

About (4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone

(4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone (PubChem CID 21027393) has the molecular formula C25H14F3N3O and a molecular weight of 429.40 g/mol. Its IUPAC name is (4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone.

Molecular Properties

Compound Name(4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone
PubChem CID21027393
Molecular FormulaC25H14F3N3O
Molecular Weight429.40 g/mol
Exact Mass429.11
IUPAC Name(4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone
SMILESO=C(c1ccc(F)cc1)c1cccc2c(-c3ccnc(F)c3)c(-c3ccc(F)cc3)nn12
InChIInChI=1S/C25H14F3N3O/c26-18-8-4-15(5-9-18)24-23(17-12-13-29-22(28)14-17)20-2-1-3-21(31(20)30-24)25(32)16-6-10-19(27)11-7-16/h1-14H
InChIKeyXIJWUGBJVTWFPG-UHFFFAOYSA-N
XLogP5.71
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500429.40
LogP ≤ 55.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

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
8-[4-(1-Methylpyrazol-4-yl)phenyl]-1,6-naphthyridine-2-carboxamide
CID 118660845
N-(3-fluoro-4-pyridinyl)-2-phenylpyrazolo[1,5-a]pyridine-6-carboxamide
CID 165415060
1-[1-(Pyridin-2-Yl)indolizin-3-Yl]ethan-1-One
CID 54759170
[4-[2-(2,4-Difluorophenyl)ethyl]piperazin-1-yl]-pyrazolo[1,5-a]pyridin-7-ylmethanone
CID 57400053
(3-Fluorophenyl)-(2-methylindolizin-3-yl)methanone
CID 2322044
(2-Fluorophenyl)-(2-methylindolizin-3-yl)methanone
CID 2322045
2-phenyl-3-pyridin-4-yl-6,7-dihydro-5H-indazol-4-one
CID 3241417
2-(4-Fluorophenyl)-7-methyl-3-(pyridin-4-yl)pyrazolo[1,5-a]pyridine
CID 9836051
4-Fluoro-2-(4-fluorophenyl)-3-(pyridin-4-yl)pyrazolo[1,5-a]pyridine
CID 9879605
N-Pyridin-4-yl-4-(3-pyridin-3-yl-5-trifluoromethyl-pyrazol-1-yl)-benzamide
CID 17748340

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone?
The IUPAC name of (4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone (CID 21027393) is (4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone.
What is the SMILES notation for (4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone?
The canonical SMILES for (4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone is O=C(c1ccc(F)cc1)c1cccc2c(-c3ccnc(F)c3)c(-c3ccc(F)cc3)nn12.
What is the InChIKey of (4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone?
The InChIKey is XIJWUGBJVTWFPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H14F3N3O/c26-18-8-4-15(5-9-18)24-23(17-12-13-29-22(28)14-17)20-2-1-3-21(31(20)30-24)25(32)16-6-10-19(27)11-7-16/h1-14H.
What are the key properties of (4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone?
(4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone has a molecular weight of 429.40 g/mol, XLogP of 5.71, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-[2-(4-fluorophenyl)-3-(2-fluoro-4-pyridinyl)pyrazolo[1,5-a]pyridin-7-yl]methanone is sourced from PubChem (CID 21027393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).