6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid

C25H28N4O5 — CID 175000294

IUPAC6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid
SMILESCCCOc1ccc(N2CCc3c(C(=O)O)nn(-c4ccc(OC)cc4)c3C2=O)cc1NCC
InChIInChI=1S/C25H28N4O5/c1-4-14-34-21-11-8-17(15-20(21)26-5-2)28-13-12-19-22(25(31)32)27-29(23(19)24(28)30)16-6-9-18(33-3)10-7-16/h6-11,15,26H,4-5,12-14H2,1-3H3,(H,31,32)
InChIKeyCZOWPVOAGHAWEI-UHFFFAOYSA-N
MW464.52 g/mol
LogP4.00
Rot. Bonds9

About 6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid

6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid (PubChem CID 175000294) has the molecular formula C25H28N4O5 and a molecular weight of 464.52 g/mol. Its IUPAC name is 6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid
PubChem CID175000294
Molecular FormulaC25H28N4O5
Molecular Weight464.52 g/mol
Exact Mass464.21
IUPAC Name6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid
SMILESCCCOc1ccc(N2CCc3c(C(=O)O)nn(-c4ccc(OC)cc4)c3C2=O)cc1NCC
InChIInChI=1S/C25H28N4O5/c1-4-14-34-21-11-8-17(15-20(21)26-5-2)28-13-12-19-22(25(31)32)27-29(23(19)24(28)30)16-6-9-18(33-3)10-7-16/h6-11,15,26H,4-5,12-14H2,1-3H3,(H,31,32)
InChIKeyCZOWPVOAGHAWEI-UHFFFAOYSA-N
XLogP4.00
TPSA105.92 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.52
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-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

ethyl 6-[3-chloro-4-(4-oxopentoxy)phenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate
CID 118929164
1-(4-methoxyphenyl)-6-[4-(4-methylpiperazin-1-yl)phenyl]-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid
CID 175000409
1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxoazepan-1-yl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid
CID 175000389
1-(4-methoxyphenyl)-6-[4-(2-methylpropanoylamino)phenyl]-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid
CID 175000319
1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperazin-1-yl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid
CID 141435084
ethyl 1-(4-methoxyphenyl)-6-[3-methyl-4-[[6-[(2-methylpropan-2-yl)oxy]-6-oxohexanoyl]amino]phenyl]-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate
CID 159426240
1-(4-fluorophenyl)-6-(4-methoxyphenyl)-3-propyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one
CID 10619709
ethyl 1-(4-methoxyphenyl)-6-(4-nitrophenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate
CID 11711790
4-[4-[3-carbamoyl-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridin-6-yl]anilino]butanoic acid
CID 163203151
ethyl 6-[4-[(2-bromoacetyl)amino]phenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate
CID 58618147
ethyl 6-[4-[acetyl(propyl)amino]phenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate
CID 142253147
methyl 1-(4-methoxyphenyl)-6-(4-nitrophenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate
CID 175673444

Frequently Asked Questions

What is the IUPAC name of 6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid?
The IUPAC name of 6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid (CID 175000294) is 6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid?
The canonical SMILES for 6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid is CCCOc1ccc(N2CCc3c(C(=O)O)nn(-c4ccc(OC)cc4)c3C2=O)cc1NCC.
What is the InChIKey of 6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid?
The InChIKey is CZOWPVOAGHAWEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N4O5/c1-4-14-34-21-11-8-17(15-20(21)26-5-2)28-13-12-19-22(25(31)32)27-29(23(19)24(28)30)16-6-9-18(33-3)10-7-16/h6-11,15,26H,4-5,12-14H2,1-3H3,(H,31,32).
What are the key properties of 6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid?
6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid has a molecular weight of 464.52 g/mol, XLogP of 4.00, 9 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(ethylamino)-4-propoxyphenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid is sourced from PubChem (CID 175000294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).