3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine

C17H12N4 — CID 71253684

IUPAC3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine
SMILESc1ccc(-c2n[nH]c3cnc(-c4cccnc4)cc23)cc1
InChIInChI=1S/C17H12N4/c1-2-5-12(6-3-1)17-14-9-15(13-7-4-8-18-10-13)19-11-16(14)20-21-17/h1-11H,(H,20,21)
InChIKeyOQULQTMKDZGXOL-UHFFFAOYSA-N
MW272.31 g/mol
LogP3.69
Rot. Bonds2

About 3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine

3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine (PubChem CID 71253684) has the molecular formula C17H12N4 and a molecular weight of 272.31 g/mol. Its IUPAC name is 3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine
PubChem CID71253684
Molecular FormulaC17H12N4
Molecular Weight272.31 g/mol
Exact Mass272.11
IUPAC Name3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine
SMILESc1ccc(-c2n[nH]c3cnc(-c4cccnc4)cc23)cc1
InChIInChI=1S/C17H12N4/c1-2-5-12(6-3-1)17-14-9-15(13-7-4-8-18-10-13)19-11-16(14)20-21-17/h1-11H,(H,20,21)
InChIKeyOQULQTMKDZGXOL-UHFFFAOYSA-N
XLogP3.69
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine?
The IUPAC name of 3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine (CID 71253684) is 3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine.
What is the SMILES notation for 3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine?
The canonical SMILES for 3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine is c1ccc(-c2n[nH]c3cnc(-c4cccnc4)cc23)cc1.
What is the InChIKey of 3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine?
The InChIKey is OQULQTMKDZGXOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N4/c1-2-5-12(6-3-1)17-14-9-15(13-7-4-8-18-10-13)19-11-16(14)20-21-17/h1-11H,(H,20,21).
What are the key properties of 3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine?
3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine has a molecular weight of 272.31 g/mol, XLogP of 3.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-5-pyridin-3-yl-1H-pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 71253684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).