6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one

C26H20N2O2 — CID 149017158

IUPAC6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one
SMILESCC1=C(c2ccc(O)cc2)C(=O)n2nc(-c3ccccc3)c(-c3ccccc3)c2C1
InChIInChI=1S/C26H20N2O2/c1-17-16-22-24(18-8-4-2-5-9-18)25(20-10-6-3-7-11-20)27-28(22)26(30)23(17)19-12-14-21(29)15-13-19/h2-15,29H,16H2,1H3
InChIKeyQCTMAZYPAFIGKP-UHFFFAOYSA-N
MW392.46 g/mol
LogP5.59
Rot. Bonds3

About 6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one

6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one (PubChem CID 149017158) has the molecular formula C26H20N2O2 and a molecular weight of 392.46 g/mol. Its IUPAC name is 6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one.

Molecular Properties

Compound Name6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one
PubChem CID149017158
Molecular FormulaC26H20N2O2
Molecular Weight392.46 g/mol
Exact Mass392.15
IUPAC Name6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one
SMILESCC1=C(c2ccc(O)cc2)C(=O)n2nc(-c3ccccc3)c(-c3ccccc3)c2C1
InChIInChI=1S/C26H20N2O2/c1-17-16-22-24(18-8-4-2-5-9-18)25(20-10-6-3-7-11-20)27-28(22)26(30)23(17)19-12-14-21(29)15-13-19/h2-15,29H,16H2,1H3
InChIKeyQCTMAZYPAFIGKP-UHFFFAOYSA-N
XLogP5.59
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.46
LogP ≤ 55.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one?
The IUPAC name of 6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one (CID 149017158) is 6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one.
What is the SMILES notation for 6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one?
The canonical SMILES for 6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one is CC1=C(c2ccc(O)cc2)C(=O)n2nc(-c3ccccc3)c(-c3ccccc3)c2C1.
What is the InChIKey of 6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one?
The InChIKey is QCTMAZYPAFIGKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20N2O2/c1-17-16-22-24(18-8-4-2-5-9-18)25(20-10-6-3-7-11-20)27-28(22)26(30)23(17)19-12-14-21(29)15-13-19/h2-15,29H,16H2,1H3.
What are the key properties of 6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one?
6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one has a molecular weight of 392.46 g/mol, XLogP of 5.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-hydroxyphenyl)-5-methyl-2,3-diphenyl-4H-pyrazolo[1,5-a]pyridin-7-one is sourced from PubChem (CID 149017158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).