3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine

C17H19N3 — CID 142608457

IUPAC3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine
SMILESCc1cc2c(nc1-c1ccccc1)c(C)nn2C(C)C
InChIInChI=1S/C17H19N3/c1-11(2)20-15-10-12(3)16(14-8-6-5-7-9-14)18-17(15)13(4)19-20/h5-11H,1-4H3
InChIKeyNHTZYYDADSWQFF-UHFFFAOYSA-N
MW265.36 g/mol
LogP4.30
Rot. Bonds2

About 3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine

3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine (PubChem CID 142608457) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is 3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine.

Molecular Properties

Compound Name3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine
PubChem CID142608457
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC Name3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine
SMILESCc1cc2c(nc1-c1ccccc1)c(C)nn2C(C)C
InChIInChI=1S/C17H19N3/c1-11(2)20-15-10-12(3)16(14-8-6-5-7-9-14)18-17(15)13(4)19-20/h5-11H,1-4H3
InChIKeyNHTZYYDADSWQFF-UHFFFAOYSA-N
XLogP4.30
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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6-Fluoro-2-(4-fluorophenyl)-3-(pyridin-4-yl)pyrazolo[1,5-a]pyridine
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Ethyl-indol-1-yl-pyridin-4-yl-amine
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Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine?
The IUPAC name of 3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine (CID 142608457) is 3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine.
What is the SMILES notation for 3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine?
The canonical SMILES for 3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine is Cc1cc2c(nc1-c1ccccc1)c(C)nn2C(C)C.
What is the InChIKey of 3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine?
The InChIKey is NHTZYYDADSWQFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-11(2)20-15-10-12(3)16(14-8-6-5-7-9-14)18-17(15)13(4)19-20/h5-11H,1-4H3.
What are the key properties of 3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine?
3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine has a molecular weight of 265.36 g/mol, XLogP of 4.30, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-5-phenyl-1-propan-2-ylpyrazolo[4,5-b]pyridine is sourced from PubChem (CID 142608457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).