1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid

C14H10FN3O2 — CID 12018217

IUPAC1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid
SMILESO=C(O)c1nn(Cc2ccccc2F)c2ncccc12
InChIInChI=1S/C14H10FN3O2/c15-11-6-2-1-4-9(11)8-18-13-10(5-3-7-16-13)12(17-18)14(19)20/h1-7H,8H2,(H,19,20)
InChIKeyQOMRCMAKWINLAN-UHFFFAOYSA-N
MW271.25 g/mol
LogP2.32
Rot. Bonds3

About 1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid

1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid (PubChem CID 12018217) has the molecular formula C14H10FN3O2 and a molecular weight of 271.25 g/mol. Its IUPAC name is 1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid
PubChem CID12018217
Molecular FormulaC14H10FN3O2
Molecular Weight271.25 g/mol
Exact Mass271.08
IUPAC Name1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid
SMILESO=C(O)c1nn(Cc2ccccc2F)c2ncccc12
InChIInChI=1S/C14H10FN3O2/c15-11-6-2-1-4-9(11)8-18-13-10(5-3-7-16-13)12(17-18)14(19)20/h1-7H,8H2,(H,19,20)
InChIKeyQOMRCMAKWINLAN-UHFFFAOYSA-N
XLogP2.32
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.25
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-cyclopropyl-1-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
CID 2525992
3-(5-Methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-ylamino)-benzoic acid
CID 743045
6-phenyl-1-[(pyridin-4-yl)methyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
CID 7064016
5,7-Diphenylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 771943
5-Phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 655493
2-(5-p-tolyl-1H-pyrazol-1-yl)isonicotinic acid
CID 76901247
7-(4-Fluorophenyl)pyrazolo(1,5-a)pyrimidine-2-carboxylic acid
CID 4775471
7-(1-Ethyl-5-methyl-1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 4776201
6-(4-Benzoylphenyl)-1-(Pyridin-4-Ylmethyl)-1h-Pyrazolo[3,4-B]pyridine-4-Carboxylic Acid
CID 60196213
4-[(1-Benzylpyrazolo[3,4-d]pyrimidin-4-yl)amino]benzoic acid
CID 845965
O3-(2-fluorobenzoyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carbohydroximamide
CID 9584170
3-(1-p-Tolyl-1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)-benzoic acid
CID 721046

Frequently Asked Questions

What is the IUPAC name of 1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid?
The IUPAC name of 1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid (CID 12018217) is 1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid.
What is the SMILES notation for 1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid?
The canonical SMILES for 1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid is O=C(O)c1nn(Cc2ccccc2F)c2ncccc12.
What is the InChIKey of 1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid?
The InChIKey is QOMRCMAKWINLAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN3O2/c15-11-6-2-1-4-9(11)8-18-13-10(5-3-7-16-13)12(17-18)14(19)20/h1-7H,8H2,(H,19,20).
What are the key properties of 1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid?
1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid has a molecular weight of 271.25 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridine-3-carboxylic acid is sourced from PubChem (CID 12018217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).