5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine

C19H16N4 — CID 121388923

IUPAC5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine
SMILESCc1ccc(-c2cnc3nn(-c4cccnc4)cc3c2)cc1C
InChIInChI=1S/C19H16N4/c1-13-5-6-15(8-14(13)2)16-9-17-12-23(22-19(17)21-10-16)18-4-3-7-20-11-18/h3-12H,1-2H3
InChIKeyMAYKSNJNMDIONG-UHFFFAOYSA-N
MW300.37 g/mol
LogP4.10
Rot. Bonds2

About 5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine

5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine (PubChem CID 121388923) has the molecular formula C19H16N4 and a molecular weight of 300.37 g/mol. Its IUPAC name is 5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine
PubChem CID121388923
Molecular FormulaC19H16N4
Molecular Weight300.37 g/mol
Exact Mass300.14
IUPAC Name5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine
SMILESCc1ccc(-c2cnc3nn(-c4cccnc4)cc3c2)cc1C
InChIInChI=1S/C19H16N4/c1-13-5-6-15(8-14(13)2)16-9-17-12-23(22-19(17)21-10-16)18-4-3-7-20-11-18/h3-12H,1-2H3
InChIKeyMAYKSNJNMDIONG-UHFFFAOYSA-N
XLogP4.10
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.37
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-dipyridin-3-ylindazole
CID 121379381
3-(4-methyl-3-pyridin-4-ylpyrazol-1-yl)pyridine
CID 158876961
5-methoxy-2-pyridin-3-ylindazole
CID 121320237
2-methoxy-5-(1-pyridin-3-yltriazol-4-yl)pyridine
CID 46183505
2,3-dimethyl-5-pyridin-3-ylpyridine
CID 122608541
5,10-bis(3,4-dimethylphenyl)benzo[g]isoquinoline
CID 59183666
3,6-bis(4-naphthalen-2-ylphenyl)-9-pyridin-3-ylcarbazole
CID 177074748
3-(4-isothiocyanato-3-methylpyrazol-1-yl)pyridine
CID 86700630
N-[[3-(3,4-dimethylphenyl)-1-phenylpyrazol-4-yl]methyl]-N-methylpyridine-3-carboxamide
CID 32688509
5-(3,4-dimethylphenyl)-3-methylpyridin-2-amine
CID 83170241
5-methyl-4-oxo-1-pyridin-3-ylpyridazine-3-carboxylic acid
CID 58072535
2-fluoro-3-methyl-5-pyridin-3-ylpyridine
CID 46315737

Frequently Asked Questions

What is the IUPAC name of 5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine?
The IUPAC name of 5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine (CID 121388923) is 5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine.
What is the SMILES notation for 5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine?
The canonical SMILES for 5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine is Cc1ccc(-c2cnc3nn(-c4cccnc4)cc3c2)cc1C.
What is the InChIKey of 5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine?
The InChIKey is MAYKSNJNMDIONG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4/c1-13-5-6-15(8-14(13)2)16-9-17-12-23(22-19(17)21-10-16)18-4-3-7-20-11-18/h3-12H,1-2H3.
What are the key properties of 5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine?
5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine has a molecular weight of 300.37 g/mol, XLogP of 4.10, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,4-dimethylphenyl)-2-pyridin-3-ylpyrazolo[3,4-b]pyridine is sourced from PubChem (CID 121388923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).