6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine

C16H17N3O2 — CID 169417475

IUPAC6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine
SMILESCOc1ccc(-c2cc(C)c3cn(C)nc3n2)cc1OC
InChIInChI=1S/C16H17N3O2/c1-10-7-13(17-16-12(10)9-19(2)18-16)11-5-6-14(20-3)15(8-11)21-4/h5-9H,1-4H3
InChIKeyIHFXKUGXLSERLS-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.96
Rot. Bonds3

About 6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine

6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine (PubChem CID 169417475) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine
PubChem CID169417475
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine
SMILESCOc1ccc(-c2cc(C)c3cn(C)nc3n2)cc1OC
InChIInChI=1S/C16H17N3O2/c1-10-7-13(17-16-12(10)9-19(2)18-16)11-5-6-14(20-3)15(8-11)21-4/h5-9H,1-4H3
InChIKeyIHFXKUGXLSERLS-UHFFFAOYSA-N
XLogP2.96
TPSA49.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine
CID 169417519
4-(3,4-dimethoxyphenyl)-2-methoxy-6-(4-methylphenyl)pyrimidine
CID 2854304
2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridine
CID 622689
3-(3,4-dimethoxyphenyl)-1-methylpyrazole-5-carbaldehyde
CID 84761406
2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-6-amine
CID 82060154
6-(3,4-dimethoxyphenyl)-2-methylpyridazin-3-one
CID 7659900
7-chloro-5-(3,4-dimethoxyphenyl)-3-methylpyrazolo[1,5-a]pyrimidine
CID 89057831
2-(4-fluorophenyl)-6,7-dimethoxy-4-methylquinoline
CID 102444237
6-(3,4-dimethoxyphenyl)-2-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 155964904
6-(3-fluoro-4-methoxyphenyl)-1,3,4-trimethylpyrazolo[5,4-b]pyridine
CID 169421254
4-chloro-6-(3,4-dimethoxyphenyl)pyrimidin-2-amine
CID 24743459
2-(3,4-dimethoxyphenyl)-8-methoxypyrido[1,2-a]pyrimidin-4-one
CID 146523465

Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine?
The IUPAC name of 6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine (CID 169417475) is 6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine.
What is the SMILES notation for 6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine?
The canonical SMILES for 6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine is COc1ccc(-c2cc(C)c3cn(C)nc3n2)cc1OC.
What is the InChIKey of 6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine?
The InChIKey is IHFXKUGXLSERLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-10-7-13(17-16-12(10)9-19(2)18-16)11-5-6-14(20-3)15(8-11)21-4/h5-9H,1-4H3.
What are the key properties of 6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine?
6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine has a molecular weight of 283.33 g/mol, XLogP of 2.96, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine is sourced from PubChem (CID 169417475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).