6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile

C19H14N2O2 — CID 25190444

IUPAC6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile
SMILESCc1ccc(O)c(-c2cc(-c3ccccc3)c(C#N)c(=O)[nH]2)c1
InChIInChI=1S/C19H14N2O2/c1-12-7-8-18(22)15(9-12)17-10-14(13-5-3-2-4-6-13)16(11-20)19(23)21-17/h2-10,22H,1H3,(H,21,23)
InChIKeyIALVZRHASRCEQM-UHFFFAOYSA-N
MW302.33 g/mol
LogP3.59
Rot. Bonds2

About 6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile

6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile (PubChem CID 25190444) has the molecular formula C19H14N2O2 and a molecular weight of 302.33 g/mol. Its IUPAC name is 6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile
PubChem CID25190444
Molecular FormulaC19H14N2O2
Molecular Weight302.33 g/mol
Exact Mass302.11
IUPAC Name6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile
SMILESCc1ccc(O)c(-c2cc(-c3ccccc3)c(C#N)c(=O)[nH]2)c1
InChIInChI=1S/C19H14N2O2/c1-12-7-8-18(22)15(9-12)17-10-14(13-5-3-2-4-6-13)16(11-20)19(23)21-17/h2-10,22H,1H3,(H,21,23)
InChIKeyIALVZRHASRCEQM-UHFFFAOYSA-N
XLogP3.59
TPSA76.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(5-Bromo-2-hydroxyphenyl)-2-oxo-4-phenyl-1,2-dihydropyridine-3-carbonitrile
CID 1235170
4-(2-Hydroxy-5-methylphenyl)-2-oxo-6-phenyl-1,2-dihydropyridine-3-carbonitrile
CID 25190445
6-(2-Hydroxyphenyl)-4-(4-hydroxyphenyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
CID 25190446
6-(2-Hydroxyphenyl)-2-oxo-4-phenyl-1,2-dihydropyridine-3-carbonitrile
CID 23770859
4-(2,5-Dichloro-phenyl)-6-(4-hydroxy-biphenyl-3-yl)-2-oxo-1,2-dihydro-pyridine-3-carbonitrile
CID 44431543
6-(5-Bromo-2-hydroxyphenyl)-4-(2,4-dimethylphenyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
CID 44431552
4-(3-Chlorophenyl)-6-(5-ethyl-2-hydroxyphenyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
CID 25190447
6-(2-Hydroxyphenyl)-4-(2-methoxyphenyl)-2-oxo-1,2-dihydro-3-pyridinecarbonitrile
CID 10313795
4-(2-chlorophenyl)-6-(2-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile
CID 10381494
6-(2-hydroxyphenyl)-4-(2-methylphenyl)-2-oxo-1H-pyridine-3-carbonitrile
CID 44298950
N-benzyl-2-cyano-3-(4-hydroxy-3,5-dimethylphenyl)prop-2-enamide
CID 2130879
6-(5-Bromo-2-hydroxyphenyl)-4-(2,5-dimethylphenyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
CID 44431556

Frequently Asked Questions

What is the IUPAC name of 6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile?
The IUPAC name of 6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile (CID 25190444) is 6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile.
What is the SMILES notation for 6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile?
The canonical SMILES for 6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile is Cc1ccc(O)c(-c2cc(-c3ccccc3)c(C#N)c(=O)[nH]2)c1.
What is the InChIKey of 6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile?
The InChIKey is IALVZRHASRCEQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O2/c1-12-7-8-18(22)15(9-12)17-10-14(13-5-3-2-4-6-13)16(11-20)19(23)21-17/h2-10,22H,1H3,(H,21,23).
What are the key properties of 6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile?
6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile has a molecular weight of 302.33 g/mol, XLogP of 3.59, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1H-pyridine-3-carbonitrile is sourced from PubChem (CID 25190444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).