4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine

C20H16N4 — CID 10591208

IUPAC4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine
SMILESNc1[nH]nc2nc(/C=C/c3ccccc3)cc(-c3ccccc3)c12
InChIInChI=1S/C20H16N4/c21-19-18-17(15-9-5-2-6-10-15)13-16(22-20(18)24-23-19)12-11-14-7-3-1-4-8-14/h1-13H,(H3,21,22,23,24)/b12-11+
InChIKeyCENIUFPVUFYLLU-VAWYXSNFSA-N
MW312.38 g/mol
LogP4.38
Rot. Bonds3

About 4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine

4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine (PubChem CID 10591208) has the molecular formula C20H16N4 and a molecular weight of 312.38 g/mol. Its IUPAC name is 4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine.

Molecular Properties

Compound Name4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine
PubChem CID10591208
Molecular FormulaC20H16N4
Molecular Weight312.38 g/mol
Exact Mass312.14
IUPAC Name4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine
SMILESNc1[nH]nc2nc(/C=C/c3ccccc3)cc(-c3ccccc3)c12
InChIInChI=1S/C20H16N4/c21-19-18-17(15-9-5-2-6-10-15)13-16(22-20(18)24-23-19)12-11-14-7-3-1-4-8-14/h1-13H,(H3,21,22,23,24)/b12-11+
InChIKeyCENIUFPVUFYLLU-VAWYXSNFSA-N
XLogP4.38
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.38
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3-chlorophenyl)-4-phenyl-2H-pyrazolo[3,4-b]pyridin-3-amine
CID 46206940
2,4-diphenyl-6-[(E)-2-phenylethenyl]pyrimidine
CID 7114809
2,4-diphenyl-6-(2-phenylethenyl)pyridine
CID 3299045
[1-(3-amino-4-phenyl-2H-pyrazolo[3,4-b]pyridin-6-yl)piperidin-3-yl]methanol
CID 13138541
2-amino-4-(2-phenylethenyl)-1H-pyrimidin-6-one
CID 137217157
2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine
CID 164669085
3-phenyl-2-[[4-phenyl-6-[(E)-2-phenylethenyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]imino]-1,3-thiazolidin-4-one
CID 10528981
4-(3-nitrosophenyl)-6-pyridin-4-yl-2H-pyrazolo[3,4-b]pyridin-3-amine
CID 143241962
[3-(2-phenylethenyl)-1H-pyrazol-5-yl]methanol
CID 54512641
4-[5-[(E)-2-phenylethenyl]-1H-pyrazol-3-yl]aniline
CID 143204611
N-[4-(4-methoxyphenyl)-6-[(E)-2-(4-methoxyphenyl)ethenyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-3,4-diphenyl-1,3-thiazol-2-imine
CID 10722402
2-chloro-6-(4-methylphenyl)-4-(4-phenoxyphenyl)pyridine-3-carbonitrile;6-(4-methylphenyl)-4-(4-phenoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine
CID 162072281

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine?
The IUPAC name of 4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine (CID 10591208) is 4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine.
What is the SMILES notation for 4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine?
The canonical SMILES for 4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine is Nc1[nH]nc2nc(/C=C/c3ccccc3)cc(-c3ccccc3)c12.
What is the InChIKey of 4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine?
The InChIKey is CENIUFPVUFYLLU-VAWYXSNFSA-N. The full InChI is InChI=1S/C20H16N4/c21-19-18-17(15-9-5-2-6-10-15)13-16(22-20(18)24-23-19)12-11-14-7-3-1-4-8-14/h1-13H,(H3,21,22,23,24)/b12-11+.
What are the key properties of 4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine?
4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine has a molecular weight of 312.38 g/mol, XLogP of 4.38, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-6-[(E)-2-phenylethenyl]-2H-pyrazolo[3,4-b]pyridin-3-amine is sourced from PubChem (CID 10591208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).