1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid

C15H14N2O6 — CID 82108142

IUPAC1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid
SMILESCOc1ccccc1NC(=O)COn1cc(C(=O)O)ccc1=O
InChIInChI=1S/C15H14N2O6/c1-22-12-5-3-2-4-11(12)16-13(18)9-23-17-8-10(15(20)21)6-7-14(17)19/h2-8H,9H2,1H3,(H,16,18)(H,20,21)
InChIKeyFOZPSNXNCAWQOD-UHFFFAOYSA-N
MW318.29 g/mol
LogP0.62
Rot. Bonds6

About 1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid

1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid (PubChem CID 82108142) has the molecular formula C15H14N2O6 and a molecular weight of 318.29 g/mol. Its IUPAC name is 1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid.

Molecular Properties

Compound Name1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid
PubChem CID82108142
Molecular FormulaC15H14N2O6
Molecular Weight318.29 g/mol
Exact Mass318.09
IUPAC Name1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid
SMILESCOc1ccccc1NC(=O)COn1cc(C(=O)O)ccc1=O
InChIInChI=1S/C15H14N2O6/c1-22-12-5-3-2-4-11(12)16-13(18)9-23-17-8-10(15(20)21)6-7-14(17)19/h2-8H,9H2,1H3,(H,16,18)(H,20,21)
InChIKeyFOZPSNXNCAWQOD-UHFFFAOYSA-N
XLogP0.62
TPSA106.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.29
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-[2-(2-chloro-4-methylanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid
CID 82108213
4-[[2-(2-methoxyanilino)-2-oxoethyl]amino]benzoic acid
CID 2329032
N-(2-methoxyphenyl)-3-oxo-3-phenylpropanamide
CID 7079
2-[[2-(2-methoxyanilino)-2-oxoethyl]disulfanyl]-N-(2-methoxyphenyl)acetamide
CID 2346844
[2-(2-methoxyanilino)-2-oxoethyl] 3,3-diphenylpropanoate
CID 2356149
4-[[2-(2-methoxyanilino)-2-oxoethyl]sulfinylmethyl]benzoic acid
CID 123106758
4-[(2-methoxyphenyl)carbamoylamino]benzoic acid
CID 853793
[2-(2-methoxyanilino)-2-oxoethyl] 2-phenylbenzoate
CID 7554634
2-[4-(azetidine-1-carbonyl)-2-methoxyphenoxy]-N-(2-methoxyphenyl)acetamide
CID 17439322
N-(2-methoxyphenyl)-3-(methylamino)propanamide
CID 54773589
N-(2-methoxyphenyl)-1-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide
CID 53040738
2-[2-[tert-butyl(dimethyl)silyl]oxyphenoxy]-N-(2-methoxyphenyl)acetamide
CID 91742925

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid?
The IUPAC name of 1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid (CID 82108142) is 1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid.
What is the SMILES notation for 1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid?
The canonical SMILES for 1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid is COc1ccccc1NC(=O)COn1cc(C(=O)O)ccc1=O.
What is the InChIKey of 1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid?
The InChIKey is FOZPSNXNCAWQOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O6/c1-22-12-5-3-2-4-11(12)16-13(18)9-23-17-8-10(15(20)21)6-7-14(17)19/h2-8H,9H2,1H3,(H,16,18)(H,20,21).
What are the key properties of 1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid?
1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid has a molecular weight of 318.29 g/mol, XLogP of 0.62, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyanilino)-2-oxoethoxy]-6-oxopyridine-3-carboxylic acid is sourced from PubChem (CID 82108142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).