3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol

C22H25N3O3 — CID 143370658

IUPAC3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol
SMILESCCOCc1nn(-c2ccccc2)c2c1CCN(c1ccccc1)C2=O.CO
InChIInChI=1S/C21H21N3O2.CH4O/c1-2-26-15-19-18-13-14-23(16-9-5-3-6-10-16)21(25)20(18)24(22-19)17-11-7-4-8-12-17;1-2/h3-12H,2,13-15H2,1H3;2H,1H3
InChIKeyAEHYMKIXPKYDCO-UHFFFAOYSA-N
MW379.46 g/mol
LogP3.22
Rot. Bonds5

About 3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol

3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol (PubChem CID 143370658) has the molecular formula C22H25N3O3 and a molecular weight of 379.46 g/mol. Its IUPAC name is 3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol.

Molecular Properties

Compound Name3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol
PubChem CID143370658
Molecular FormulaC22H25N3O3
Molecular Weight379.46 g/mol
Exact Mass379.19
IUPAC Name3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol
SMILESCCOCc1nn(-c2ccccc2)c2c1CCN(c1ccccc1)C2=O.CO
InChIInChI=1S/C21H21N3O2.CH4O/c1-2-26-15-19-18-13-14-23(16-9-5-3-6-10-16)21(25)20(18)24(22-19)17-11-7-4-8-12-17;1-2/h3-12H,2,13-15H2,1H3;2H,1H3
InChIKeyAEHYMKIXPKYDCO-UHFFFAOYSA-N
XLogP3.22
TPSA67.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol?
The IUPAC name of 3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol (CID 143370658) is 3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol.
What is the SMILES notation for 3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol?
The canonical SMILES for 3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol is CCOCc1nn(-c2ccccc2)c2c1CCN(c1ccccc1)C2=O.CO.
What is the InChIKey of 3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol?
The InChIKey is AEHYMKIXPKYDCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O2.CH4O/c1-2-26-15-19-18-13-14-23(16-9-5-3-6-10-16)21(25)20(18)24(22-19)17-11-7-4-8-12-17;1-2/h3-12H,2,13-15H2,1H3;2H,1H3.
What are the key properties of 3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol?
3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol has a molecular weight of 379.46 g/mol, XLogP of 3.22, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethoxymethyl)-1,6-diphenyl-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;methanol is sourced from PubChem (CID 143370658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).