3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one

C21H20FN3O2 — CID 54151775

IUPAC3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one
SMILESCCc1nn(-c2ccc(OC)cc2)c2c1CCN(c1ccc(F)cc1)C2=O
InChIInChI=1S/C21H20FN3O2/c1-3-19-18-12-13-24(15-6-4-14(22)5-7-15)21(26)20(18)25(23-19)16-8-10-17(27-2)11-9-16/h4-11H,3,12-13H2,1-2H3
InChIKeyOIGCNPQVJAYFFB-UHFFFAOYSA-N
MW365.41 g/mol
LogP3.79
Rot. Bonds4

About 3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one

3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one (PubChem CID 54151775) has the molecular formula C21H20FN3O2 and a molecular weight of 365.41 g/mol. Its IUPAC name is 3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one.

Molecular Properties

Compound Name3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one
PubChem CID54151775
Molecular FormulaC21H20FN3O2
Molecular Weight365.41 g/mol
Exact Mass365.15
IUPAC Name3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one
SMILESCCc1nn(-c2ccc(OC)cc2)c2c1CCN(c1ccc(F)cc1)C2=O
InChIInChI=1S/C21H20FN3O2/c1-3-19-18-12-13-24(15-6-4-14(22)5-7-15)21(26)20(18)25(23-19)16-8-10-17(27-2)11-9-16/h4-11H,3,12-13H2,1-2H3
InChIKeyOIGCNPQVJAYFFB-UHFFFAOYSA-N
XLogP3.79
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.41
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one 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

1-(4-fluorophenyl)-6-(4-methoxyphenyl)-3-propyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one
CID 10619709
ethane;1-(4-methoxyphenyl)-3-(nitrosomethyl)-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[3,4-c]pyridin-7-one
CID 142253187
6-(4-aminophenyl)-1-(4-methoxyphenyl)-3-(trifluoromethyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one
CID 23635261
1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperazin-1-yl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid
CID 141435084
1-(4-methoxyphenyl)-6-[4-(4-methylpiperazin-1-yl)phenyl]-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid
CID 175000409
3-(2-hydroxypropan-2-yl)-6-(4-iodophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[5,4-c]pyridin-7-one
CID 59016561
ethyl 1-(4-methoxyphenyl)-6-(4-nitrophenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate
CID 11711790
1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxoazepan-1-yl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid
CID 175000389
6-[4-[4-[3-carbamoyl-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridin-6-yl]-N-hydroxyanilino]phenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 126495801
methanamine;1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[3,4-c]pyridine-3-carbaldehyde
CID 166529379
6-[4-[1-(cyclopentylamino)-2-methylpropan-2-yl]phenyl]-1-(4-methoxyphenyl)-3-(nitrosomethyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one
CID 142832836
3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol
CID 143370658

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one?
The IUPAC name of 3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one (CID 54151775) is 3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one.
What is the SMILES notation for 3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one?
The canonical SMILES for 3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one is CCc1nn(-c2ccc(OC)cc2)c2c1CCN(c1ccc(F)cc1)C2=O.
What is the InChIKey of 3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one?
The InChIKey is OIGCNPQVJAYFFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20FN3O2/c1-3-19-18-12-13-24(15-6-4-14(22)5-7-15)21(26)20(18)25(23-19)16-8-10-17(27-2)11-9-16/h4-11H,3,12-13H2,1-2H3.
What are the key properties of 3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one?
3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one has a molecular weight of 365.41 g/mol, XLogP of 3.79, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-6-(4-fluorophenyl)-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one is sourced from PubChem (CID 54151775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).