3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine

C20H22N4O2 — CID 66828944

IUPAC3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine
SMILESCN1CCc2c(-c3n[nH]c4ccnc(OC5CCOCC5)c34)cccc21
InChIInChI=1S/C20H22N4O2/c1-24-10-6-14-15(3-2-4-17(14)24)19-18-16(22-23-19)5-9-21-20(18)26-13-7-11-25-12-8-13/h2-5,9,13H,6-8,10-12H2,1H3,(H,22,23)
InChIKeyXBAOURRPFQXJFT-UHFFFAOYSA-N
MW350.42 g/mol
LogP3.17
Rot. Bonds3

About 3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine

3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine (PubChem CID 66828944) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is 3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine
PubChem CID66828944
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC Name3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine
SMILESCN1CCc2c(-c3n[nH]c4ccnc(OC5CCOCC5)c34)cccc21
InChIInChI=1S/C20H22N4O2/c1-24-10-6-14-15(3-2-4-17(14)24)19-18-16(22-23-19)5-9-21-20(18)26-13-7-11-25-12-8-13/h2-5,9,13H,6-8,10-12H2,1H3,(H,22,23)
InChIKeyXBAOURRPFQXJFT-UHFFFAOYSA-N
XLogP3.17
TPSA63.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine 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-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine (CID 66828944) is 3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine is CN1CCc2c(-c3n[nH]c4ccnc(OC5CCOCC5)c34)cccc21.
What is the InChIKey of 3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine?
The InChIKey is XBAOURRPFQXJFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c1-24-10-6-14-15(3-2-4-17(14)24)19-18-16(22-23-19)5-9-21-20(18)26-13-7-11-25-12-8-13/h2-5,9,13H,6-8,10-12H2,1H3,(H,22,23).
What are the key properties of 3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine?
3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine has a molecular weight of 350.42 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methyl-2,3-dihydroindol-4-yl)-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 66828944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).