methyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate

C24H18N2O3 — CID 91528400

IUPACmethyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate
SMILESCOC(=O)c1ccccc1-c1c(-c2ccccn2)c[nH]c(=O)c1-c1ccccc1
InChIInChI=1S/C24H18N2O3/c1-29-24(28)18-12-6-5-11-17(18)22-19(20-13-7-8-14-25-20)15-26-23(27)21(22)16-9-3-2-4-10-16/h2-15H,1H3,(H,26,27)
InChIKeyOQUODTBGMRBWBN-UHFFFAOYSA-N
MW382.42 g/mol
LogP4.56
Rot. Bonds4

About methyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate

methyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate (PubChem CID 91528400) has the molecular formula C24H18N2O3 and a molecular weight of 382.42 g/mol. Its IUPAC name is methyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate.

Molecular Properties

Compound Namemethyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate
PubChem CID91528400
Molecular FormulaC24H18N2O3
Molecular Weight382.42 g/mol
Exact Mass382.13
IUPAC Namemethyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate
SMILESCOC(=O)c1ccccc1-c1c(-c2ccccn2)c[nH]c(=O)c1-c1ccccc1
InChIInChI=1S/C24H18N2O3/c1-29-24(28)18-12-6-5-11-17(18)22-19(20-13-7-8-14-25-20)15-26-23(27)21(22)16-9-3-2-4-10-16/h2-15H,1H3,(H,26,27)
InChIKeyOQUODTBGMRBWBN-UHFFFAOYSA-N
XLogP4.56
TPSA72.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.42
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)benzoate
CID 12789660
methyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate
CID 71472796
methyl 2-(1-phenylisoquinolin-4-yl)benzoate
CID 147957016
methyl 2-(4-phenyl-1,3-thiazol-2-yl)benzoate
CID 142384414
manganese(2+);[4-(2-methoxycarbonylphenyl)-2-(pyridine-2-carbonylazanidyl)phenyl]-(pyridine-2-carbonyl)azanide
CID 11364151
methyl 6-methyl-4-pyridin-2-ylquinoline-2-carboxylate
CID 141467624
methyl 2-(1H-indol-3-yl)benzoate
CID 67678189
methyl 2-amino-3-phenylpyridine-4-carboxylate
CID 133098297
methyl 4-hydroxy-3,5-dipyridin-2-ylbenzoate
CID 135496844
methyl 4-methoxy-3-pyridin-2-ylbenzoate
CID 70840507
methyl 6-bromo-4-pyridin-2-ylquinoline-2-carboxylate
CID 141467629
methyl 2-(1H-indol-3-yl)pyridine-3-carboxylate
CID 15287367

Frequently Asked Questions

What is the IUPAC name of methyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate?
The IUPAC name of methyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate (CID 91528400) is methyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate.
What is the SMILES notation for methyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate?
The canonical SMILES for methyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate is COC(=O)c1ccccc1-c1c(-c2ccccn2)c[nH]c(=O)c1-c1ccccc1.
What is the InChIKey of methyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate?
The InChIKey is OQUODTBGMRBWBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N2O3/c1-29-24(28)18-12-6-5-11-17(18)22-19(20-13-7-8-14-25-20)15-26-23(27)21(22)16-9-3-2-4-10-16/h2-15H,1H3,(H,26,27).
What are the key properties of methyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate?
methyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate has a molecular weight of 382.42 g/mol, XLogP of 4.56, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate is sourced from PubChem (CID 91528400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).