5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine

C22H25N5 — CID 142594027

IUPAC5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine
SMILESCC(C)c1c(-c2cc3cn[nH]c3cn2)[nH]c2ccc(C3CCNCC3)cc12
InChIInChI=1S/C22H25N5/c1-13(2)21-17-9-15(14-5-7-23-8-6-14)3-4-18(17)26-22(21)19-10-16-11-25-27-20(16)12-24-19/h3-4,9-14,23,26H,5-8H2,1-2H3,(H,25,27)
InChIKeyHBEZHJNGZZTYOT-UHFFFAOYSA-N
MW359.48 g/mol
LogP4.70
Rot. Bonds3

About 5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine

5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine (PubChem CID 142594027) has the molecular formula C22H25N5 and a molecular weight of 359.48 g/mol. Its IUPAC name is 5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine
PubChem CID142594027
Molecular FormulaC22H25N5
Molecular Weight359.48 g/mol
Exact Mass359.21
IUPAC Name5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine
SMILESCC(C)c1c(-c2cc3cn[nH]c3cn2)[nH]c2ccc(C3CCNCC3)cc12
InChIInChI=1S/C22H25N5/c1-13(2)21-17-9-15(14-5-7-23-8-6-14)3-4-18(17)26-22(21)19-10-16-11-25-27-20(16)12-24-19/h3-4,9-14,23,26H,5-8H2,1-2H3,(H,25,27)
InChIKeyHBEZHJNGZZTYOT-UHFFFAOYSA-N
XLogP4.70
TPSA69.39 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.48
LogP ≤ 54.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Analyze 5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-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 5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine?
The IUPAC name of 5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine (CID 142594027) is 5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine.
What is the SMILES notation for 5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine?
The canonical SMILES for 5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine is CC(C)c1c(-c2cc3cn[nH]c3cn2)[nH]c2ccc(C3CCNCC3)cc12.
What is the InChIKey of 5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine?
The InChIKey is HBEZHJNGZZTYOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N5/c1-13(2)21-17-9-15(14-5-7-23-8-6-14)3-4-18(17)26-22(21)19-10-16-11-25-27-20(16)12-24-19/h3-4,9-14,23,26H,5-8H2,1-2H3,(H,25,27).
What are the key properties of 5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine?
5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine has a molecular weight of 359.48 g/mol, XLogP of 4.70, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 142594027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).