6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

C22H26N4O2 — CID 9357716

IUPAC6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1ccc(OCCNC(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)cc1
InChIInChI=1S/C22H26N4O2/c1-14(2)26-21-19(13-24-26)18(12-20(25-21)16-6-7-16)22(27)23-10-11-28-17-8-4-15(3)5-9-17/h4-5,8-9,12-14,16H,6-7,10-11H2,1-3H3,(H,23,27)
InChIKeyCQXXLNNSWUXCJA-UHFFFAOYSA-N
MW378.48 g/mol
LogP4.01
Rot. Bonds7

About 6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 9357716) has the molecular formula C22H26N4O2 and a molecular weight of 378.48 g/mol. Its IUPAC name is 6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID9357716
Molecular FormulaC22H26N4O2
Molecular Weight378.48 g/mol
Exact Mass378.21
IUPAC Name6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1ccc(OCCNC(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)cc1
InChIInChI=1S/C22H26N4O2/c1-14(2)26-21-19(13-24-26)18(12-20(25-21)16-6-7-16)22(27)23-10-11-28-17-8-4-15(3)5-9-17/h4-5,8-9,12-14,16H,6-7,10-11H2,1-3H3,(H,23,27)
InChIKeyCQXXLNNSWUXCJA-UHFFFAOYSA-N
XLogP4.01
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.48
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide 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 6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 9357716) is 6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is Cc1ccc(OCCNC(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)cc1.
What is the InChIKey of 6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is CQXXLNNSWUXCJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O2/c1-14(2)26-21-19(13-24-26)18(12-20(25-21)16-6-7-16)22(27)23-10-11-28-17-8-4-15(3)5-9-17/h4-5,8-9,12-14,16H,6-7,10-11H2,1-3H3,(H,23,27).
What are the key properties of 6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 378.48 g/mol, XLogP of 4.01, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-[2-(4-methylphenoxy)ethyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 9357716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).