6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide

C20H22N4O3 — CID 134801864

IUPAC6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCOc1ccccc1-c1cc(C(=O)NC2CCOCC2)c2cnn(C)c2n1
InChIInChI=1S/C20H22N4O3/c1-24-19-16(12-21-24)15(20(25)22-13-7-9-27-10-8-13)11-17(23-19)14-5-3-4-6-18(14)26-2/h3-6,11-13H,7-10H2,1-2H3,(H,22,25)
InChIKeyZHGCKWZURVWFNV-UHFFFAOYSA-N
MW366.42 g/mol
LogP2.55
Rot. Bonds4

About 6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide

6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 134801864) has the molecular formula C20H22N4O3 and a molecular weight of 366.42 g/mol. Its IUPAC name is 6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID134801864
Molecular FormulaC20H22N4O3
Molecular Weight366.42 g/mol
Exact Mass366.17
IUPAC Name6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCOc1ccccc1-c1cc(C(=O)NC2CCOCC2)c2cnn(C)c2n1
InChIInChI=1S/C20H22N4O3/c1-24-19-16(12-21-24)15(20(25)22-13-7-9-27-10-8-13)11-17(23-19)14-5-3-4-6-18(14)26-2/h3-6,11-13H,7-10H2,1-2H3,(H,22,25)
InChIKeyZHGCKWZURVWFNV-UHFFFAOYSA-N
XLogP2.55
TPSA78.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide (CID 134801864) is 6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide is COc1ccccc1-c1cc(C(=O)NC2CCOCC2)c2cnn(C)c2n1.
What is the InChIKey of 6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is ZHGCKWZURVWFNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3/c1-24-19-16(12-21-24)15(20(25)22-13-7-9-27-10-8-13)11-17(23-19)14-5-3-4-6-18(14)26-2/h3-6,11-13H,7-10H2,1-2H3,(H,22,25).
What are the key properties of 6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 366.42 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyphenyl)-1-methyl-N-(oxan-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 134801864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).