2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine

C18H21N3O — CID 169417519

IUPAC2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine
SMILESCCn1cc2c(C)cc(-c3ccc(OC)c(C)c3C)nc2n1
InChIInChI=1S/C18H21N3O/c1-6-21-10-15-11(2)9-16(19-18(15)20-21)14-7-8-17(22-5)13(4)12(14)3/h7-10H,6H2,1-5H3
InChIKeyPCSRDPGFTPFMRA-UHFFFAOYSA-N
MW295.39 g/mol
LogP4.05
Rot. Bonds3

About 2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine

2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine (PubChem CID 169417519) has the molecular formula C18H21N3O and a molecular weight of 295.39 g/mol. Its IUPAC name is 2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine
PubChem CID169417519
Molecular FormulaC18H21N3O
Molecular Weight295.39 g/mol
Exact Mass295.17
IUPAC Name2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine
SMILESCCn1cc2c(C)cc(-c3ccc(OC)c(C)c3C)nc2n1
InChIInChI=1S/C18H21N3O/c1-6-21-10-15-11(2)9-16(19-18(15)20-21)14-7-8-17(22-5)13(4)12(14)3/h7-10H,6H2,1-5H3
InChIKeyPCSRDPGFTPFMRA-UHFFFAOYSA-N
XLogP4.05
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-(3,4-dimethoxyphenyl)-2,4-dimethylpyrazolo[3,4-b]pyridine
CID 169417475
[4-(4-methoxy-2,3-dimethylphenyl)-6-methylpyrimidin-2-yl]methanamine
CID 82300078
1-[2-[4-(4-methoxy-2,3-dimethylphenyl)triazol-1-yl]ethyl]-3,5-dimethyl-1,2,4-triazole
CID 70710332
2-ethyl-4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazole
CID 116970066
6-(4-methoxy-2,3-dimethylphenyl)-2-methylpyrimidine-4-carboxylic acid
CID 82306334
4-(4-methoxy-2,3-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine
CID 95474541
7-bromo-2-ethyl-6-methoxyindazole
CID 175206987
N-[2-(4-methoxy-2,3-dimethylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3,4-dimethylpyrazole-1-carboxamide
CID 90302740
1-ethyl-3,4-dimethylpyrazole
CID 23556587
6-(4-methoxy-2,3-dimethylphenyl)pyridazin-3-amine
CID 82474066
2-ethyl-5-methoxyindazole
CID 10856015
2-(4-methoxy-2,3-dimethylphenyl)-5-methyl-4-[(4-methylpyrazol-1-yl)methyl]-1,3-oxazole
CID 56739679

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine?
The IUPAC name of 2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine (CID 169417519) is 2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine.
What is the SMILES notation for 2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine?
The canonical SMILES for 2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine is CCn1cc2c(C)cc(-c3ccc(OC)c(C)c3C)nc2n1.
What is the InChIKey of 2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine?
The InChIKey is PCSRDPGFTPFMRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O/c1-6-21-10-15-11(2)9-16(19-18(15)20-21)14-7-8-17(22-5)13(4)12(14)3/h7-10H,6H2,1-5H3.
What are the key properties of 2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine?
2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine has a molecular weight of 295.39 g/mol, XLogP of 4.05, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-(4-methoxy-2,3-dimethylphenyl)-4-methylpyrazolo[3,4-b]pyridine is sourced from PubChem (CID 169417519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).