2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid

C25H17FN4O2 — CID 91062342

IUPAC2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid
SMILESCc1c(C(=O)O)ccnc1-c1ccn2nc(-c3ccc(F)cc3)c(-c3ccncc3)c2c1
InChIInChI=1S/C25H17FN4O2/c1-15-20(25(31)32)8-12-28-23(15)18-9-13-30-21(14-18)22(16-6-10-27-11-7-16)24(29-30)17-2-4-19(26)5-3-17/h2-14H,1H3,(H,31,32)
InChIKeyGVKMZDQWHZHSSR-UHFFFAOYSA-N
MW424.44 g/mol
LogP5.27
Rot. Bonds4

About 2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid

2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid (PubChem CID 91062342) has the molecular formula C25H17FN4O2 and a molecular weight of 424.44 g/mol. Its IUPAC name is 2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid
PubChem CID91062342
Molecular FormulaC25H17FN4O2
Molecular Weight424.44 g/mol
Exact Mass424.13
IUPAC Name2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid
SMILESCc1c(C(=O)O)ccnc1-c1ccn2nc(-c3ccc(F)cc3)c(-c3ccncc3)c2c1
InChIInChI=1S/C25H17FN4O2/c1-15-20(25(31)32)8-12-28-23(15)18-9-13-30-21(14-18)22(16-6-10-27-11-7-16)24(29-30)17-2-4-19(26)5-3-17/h2-14H,1H3,(H,31,32)
InChIKeyGVKMZDQWHZHSSR-UHFFFAOYSA-N
XLogP5.27
TPSA80.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.44
LogP ≤ 55.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-phenyl-1-[(pyridin-4-yl)methyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
CID 7064016
2-(1,5-dimethyl-1H-pyrazol-4-yl)quinoline-4-carboxylic acid
CID 3164943
2-[(5-Methyl-1H-pyrazol-1-yl)methyl]-4-quinolinecarboxylic acid
CID 6485411
1-(2-Aminoethyl)-3-[2-(Quinolin-3-Yl)pyridin-4-Yl]-1h-Pyrazole-5-Carboxylic Acid
CID 9826115
FR-166124
CID 9910335
2-(1-ethyl-1H-pyrazol-4-yl)quinoline-4-carboxylic acid
CID 6485380
3-(1-Ethyl-1h-Indol-3-Yl)-1-Methyl-1h-Pyrazole-5-Carboxylic Acid
CID 122164592
4-(4-(3-(pyridin-2-yl)-1H-pyrazol-4-yl)pyridin-2-yl)benzoic acid
CID 45487437
3-[(6-Chloro-2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]benzoic acid
CID 60151013
6-[(6-Chloro-2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid
CID 60151147
6-[(2-Phenyl-6-vinylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid
CID 60151150
6-[[2-Phenyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-3-yl]methyl]pyridine-2-carboxylic acid
CID 60151152

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid?
The IUPAC name of 2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid (CID 91062342) is 2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid.
What is the SMILES notation for 2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid?
The canonical SMILES for 2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid is Cc1c(C(=O)O)ccnc1-c1ccn2nc(-c3ccc(F)cc3)c(-c3ccncc3)c2c1.
What is the InChIKey of 2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid?
The InChIKey is GVKMZDQWHZHSSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17FN4O2/c1-15-20(25(31)32)8-12-28-23(15)18-9-13-30-21(14-18)22(16-6-10-27-11-7-16)24(29-30)17-2-4-19(26)5-3-17/h2-14H,1H3,(H,31,32).
What are the key properties of 2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid?
2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid has a molecular weight of 424.44 g/mol, XLogP of 5.27, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-5-yl]-3-methylpyridine-4-carboxylic acid is sourced from PubChem (CID 91062342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).