methyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate

C15H14N2O4 — CID 110692910

IUPACmethyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate
SMILESCOC(=O)c1ccccc1NC(=O)c1cccn(C)c1=O
InChIInChI=1S/C15H14N2O4/c1-17-9-5-7-11(14(17)19)13(18)16-12-8-4-3-6-10(12)15(20)21-2/h3-9H,1-2H3,(H,16,18)
InChIKeyQJVIHWWGLOQTTE-UHFFFAOYSA-N
MW286.29 g/mol
LogP1.42
Rot. Bonds3

About methyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate

methyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate (PubChem CID 110692910) has the molecular formula C15H14N2O4 and a molecular weight of 286.29 g/mol. Its IUPAC name is methyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate.

Molecular Properties

Compound Namemethyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate
PubChem CID110692910
Molecular FormulaC15H14N2O4
Molecular Weight286.29 g/mol
Exact Mass286.10
IUPAC Namemethyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate
SMILESCOC(=O)c1ccccc1NC(=O)c1cccn(C)c1=O
InChIInChI=1S/C15H14N2O4/c1-17-9-5-7-11(14(17)19)13(18)16-12-8-4-3-6-10(12)15(20)21-2/h3-9H,1-2H3,(H,16,18)
InChIKeyQJVIHWWGLOQTTE-UHFFFAOYSA-N
XLogP1.42
TPSA77.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-bromophenyl)-1-methyl-2-oxopyridine-3-carboxamide
CID 110692929
methyl 4-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate
CID 110692912
methyl 2-[[1-[(2-methylphenyl)methyl]-2-oxopyridine-3-carbonyl]amino]benzoate
CID 7597894
methyl 2-[[1-[(4-fluorophenyl)methoxy]-2-oxopyridine-3-carbonyl]amino]benzoate
CID 7189982
methyl 2-[(2-bromobenzoyl)amino]benzoate
CID 723592
methyl 2-[(1,4,6-trimethyl-2-oxopyridine-3-carbonyl)amino]benzoate
CID 110861610
methyl 2-[[1-[(3-fluorophenyl)methoxy]-2-oxopyridine-3-carbonyl]amino]benzoate
CID 110382409
methyl 2-[(3-methyl-4-oxophthalazine-1-carbonyl)amino]benzoate
CID 4812601
N-(2,4-dimethoxypyrimidin-5-yl)-1-methyl-2-oxopyridine-3-carboxamide
CID 122304021
methyl 2-[(5-amino-1-methylpyrazole-4-carbonyl)amino]benzoate
CID 82546289
1-methyl-2-oxo-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide
CID 110692939
methyl 2-(2,2-dimethylpropanoylamino)benzoate
CID 546733

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate?
The IUPAC name of methyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate (CID 110692910) is methyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate.
What is the SMILES notation for methyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate?
The canonical SMILES for methyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate is COC(=O)c1ccccc1NC(=O)c1cccn(C)c1=O.
What is the InChIKey of methyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate?
The InChIKey is QJVIHWWGLOQTTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4/c1-17-9-5-7-11(14(17)19)13(18)16-12-8-4-3-6-10(12)15(20)21-2/h3-9H,1-2H3,(H,16,18).
What are the key properties of methyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate?
methyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate has a molecular weight of 286.29 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]benzoate is sourced from PubChem (CID 110692910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).