6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile

C18H12N2O2 — CID 23770859

IUPAC6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccccc2)cc(-c2ccccc2O)[nH]c1=O
InChIInChI=1S/C18H12N2O2/c19-11-15-14(12-6-2-1-3-7-12)10-16(20-18(15)22)13-8-4-5-9-17(13)21/h1-10,21H,(H,20,22)
InChIKeyLLBAPJVAKZDUIA-UHFFFAOYSA-N
MW288.31 g/mol
LogP3.29
Rot. Bonds2

About 6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile

6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile (PubChem CID 23770859) has the molecular formula C18H12N2O2 and a molecular weight of 288.31 g/mol. Its IUPAC name is 6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile
PubChem CID23770859
Molecular FormulaC18H12N2O2
Molecular Weight288.31 g/mol
Exact Mass288.09
IUPAC Name6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccccc2)cc(-c2ccccc2O)[nH]c1=O
InChIInChI=1S/C18H12N2O2/c19-11-15-14(12-6-2-1-3-7-12)10-16(20-18(15)22)13-8-4-5-9-17(13)21/h1-10,21H,(H,20,22)
InChIKeyLLBAPJVAKZDUIA-UHFFFAOYSA-N
XLogP3.29
TPSA76.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile?
The IUPAC name of 6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile (CID 23770859) is 6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile.
What is the SMILES notation for 6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile?
The canonical SMILES for 6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile is N#Cc1c(-c2ccccc2)cc(-c2ccccc2O)[nH]c1=O.
What is the InChIKey of 6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile?
The InChIKey is LLBAPJVAKZDUIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12N2O2/c19-11-15-14(12-6-2-1-3-7-12)10-16(20-18(15)22)13-8-4-5-9-17(13)21/h1-10,21H,(H,20,22).
What are the key properties of 6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile?
6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile has a molecular weight of 288.31 g/mol, XLogP of 3.29, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-hydroxyphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile is sourced from PubChem (CID 23770859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).