2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide

C25H19N3O4 — CID 135454230

IUPAC2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide
SMILESO=C(c1c(O)cc(=O)n(-c2ccccc2)c1O)N(/C=N/c1ccccc1)c1ccccc1
InChIInChI=1S/C25H19N3O4/c29-21-16-22(30)28(20-14-8-3-9-15-20)25(32)23(21)24(31)27(19-12-6-2-7-13-19)17-26-18-10-4-1-5-11-18/h1-17,29,32H/b26-17+
InChIKeyRZMQMGWEOGVTJL-YZSQISJMSA-N
MW425.44 g/mol
LogP4.26
Rot. Bonds5

About 2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide

2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide (PubChem CID 135454230) has the molecular formula C25H19N3O4 and a molecular weight of 425.44 g/mol. Its IUPAC name is 2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide
PubChem CID135454230
Molecular FormulaC25H19N3O4
Molecular Weight425.44 g/mol
Exact Mass425.14
IUPAC Name2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide
SMILESO=C(c1c(O)cc(=O)n(-c2ccccc2)c1O)N(/C=N/c1ccccc1)c1ccccc1
InChIInChI=1S/C25H19N3O4/c29-21-16-22(30)28(20-14-8-3-9-15-20)25(32)23(21)24(31)27(19-12-6-2-7-13-19)17-26-18-10-4-1-5-11-18/h1-17,29,32H/b26-17+
InChIKeyRZMQMGWEOGVTJL-YZSQISJMSA-N
XLogP4.26
TPSA95.13 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.44
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

5-Methyl-6-oxo-1,3-diphenylpyrimidin-3-ium-4-olate
CID 13433692
5-Hydroxy-6,8-dimethyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione
CID 164519518
5-Benzyl-6-hydroxy-1,3-diphenylpyrimidin-1-ium-4-one
CID 2783616
6-Hydroxy-1,3-diphenylpyrimidin-1-ium-4-one
CID 12014866
6-Hydroxy-5-methyl-1,3-diphenylpyrimidin-1-ium-4-one
CID 13598356
5-Hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione
CID 54705836
6-Ethyl-5-hydroxy-8-methyl-1,3-diphenylpyrido[2,3-d]pyrimidine-2,4,7-trione
CID 54705837
5-Hydroxy-8-methyl-1,3-diphenyl-6-(phenyliminomethyl)pyrido[2,3-d]pyrimidine-2,4,7-trione
CID 136756838
5-Hydroxy-6-methyl-3-phenyl-4H-pyrano[2,3-d]pyrimidine-4,7(3H)-dione
CID 170460064

Frequently Asked Questions

What is the IUPAC name of 2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide?
The IUPAC name of 2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide (CID 135454230) is 2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide?
The canonical SMILES for 2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide is O=C(c1c(O)cc(=O)n(-c2ccccc2)c1O)N(/C=N/c1ccccc1)c1ccccc1.
What is the InChIKey of 2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide?
The InChIKey is RZMQMGWEOGVTJL-YZSQISJMSA-N. The full InChI is InChI=1S/C25H19N3O4/c29-21-16-22(30)28(20-14-8-3-9-15-20)25(32)23(21)24(31)27(19-12-6-2-7-13-19)17-26-18-10-4-1-5-11-18/h1-17,29,32H/b26-17+.
What are the key properties of 2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide?
2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide has a molecular weight of 425.44 g/mol, XLogP of 4.26, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dihydroxy-6-oxo-N,1-diphenyl-N-(phenyliminomethyl)pyridine-3-carboxamide is sourced from PubChem (CID 135454230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).