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

C18H12N2O3 — CID 25190446

IUPAC6-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccc(O)cc2)cc(-c2ccccc2O)[nH]c1=O
InChIInChI=1S/C18H12N2O3/c19-10-15-14(11-5-7-12(21)8-6-11)9-16(20-18(15)23)13-3-1-2-4-17(13)22/h1-9,21-22H,(H,20,23)
InChIKeyZPDMQXNFMLCPDW-UHFFFAOYSA-N
MW304.31 g/mol
LogP2.99
Rot. Bonds2

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

6-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile (PubChem CID 25190446) has the molecular formula C18H12N2O3 and a molecular weight of 304.31 g/mol. Its IUPAC name is 6-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile
PubChem CID25190446
Molecular FormulaC18H12N2O3
Molecular Weight304.31 g/mol
Exact Mass304.08
IUPAC Name6-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccc(O)cc2)cc(-c2ccccc2O)[nH]c1=O
InChIInChI=1S/C18H12N2O3/c19-10-15-14(11-5-7-12(21)8-6-11)9-16(20-18(15)23)13-3-1-2-4-17(13)22/h1-9,21-22H,(H,20,23)
InChIKeyZPDMQXNFMLCPDW-UHFFFAOYSA-N
XLogP2.99
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 52.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

6-(5-Bromo-2-hydroxyphenyl)-2-oxo-4-phenyl-1,2-dihydropyridine-3-carbonitrile
CID 1235170
6-(2-Hydroxy-5-methylphenyl)-2-oxo-4-phenyl-1,2-dihydropyridine-3-carbonitrile
CID 25190444
4-(2-Hydroxy-5-methylphenyl)-2-oxo-6-phenyl-1,2-dihydropyridine-3-carbonitrile
CID 25190445
6-(2-Hydroxyphenyl)-2-oxo-4-phenyl-1,2-dihydropyridine-3-carbonitrile
CID 23770859
4-(3-Chlorophenyl)-6-(5-ethyl-2-hydroxyphenyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
CID 25190447
6-(2-hydroxyphenyl)-4-(3-nitrophenyl)-2-oxo-1H-pyridine-3-carbonitrile
CID 9996920
6-(2-Hydroxyphenyl)-4-(2-methoxyphenyl)-2-oxo-1,2-dihydro-3-pyridinecarbonitrile
CID 10313795
4-(2,5-dimethoxyphenyl)-6-(2-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile
CID 10360369
4-(2-chlorophenyl)-6-(2-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile
CID 10381494
4-(2,4-dimethoxyphenyl)-6-(2-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile
CID 10405448
6-(2-hydroxyphenyl)-4-(2-methylphenyl)-2-oxo-1H-pyridine-3-carbonitrile
CID 44298950
(2E)-N-benzyl-2-cyano-3-(4-hydroxyphenyl)prop-2-enamide
CID 696321

Frequently Asked Questions

What is the IUPAC name of 6-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile?
The IUPAC name of 6-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile (CID 25190446) is 6-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile.
What is the SMILES notation for 6-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile?
The canonical SMILES for 6-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile is N#Cc1c(-c2ccc(O)cc2)cc(-c2ccccc2O)[nH]c1=O.
What is the InChIKey of 6-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile?
The InChIKey is ZPDMQXNFMLCPDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12N2O3/c19-10-15-14(11-5-7-12(21)8-6-11)9-16(20-18(15)23)13-3-1-2-4-17(13)22/h1-9,21-22H,(H,20,23).
What are the key properties of 6-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile?
6-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile has a molecular weight of 304.31 g/mol, XLogP of 2.99, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-hydroxyphenyl)-4-(4-hydroxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile is sourced from PubChem (CID 25190446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).