methyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate

C15H14N2O3 — CID 31703569

IUPACmethyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate
SMILESCOC(=O)c1ccc(NC(=O)c2cccc(C)n2)cc1
InChIInChI=1S/C15H14N2O3/c1-10-4-3-5-13(16-10)14(18)17-12-8-6-11(7-9-12)15(19)20-2/h3-9H,1-2H3,(H,17,18)
InChIKeyZYPSJECTVQYZKK-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.43
Rot. Bonds3

About methyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate

methyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate (PubChem CID 31703569) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is methyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate.

Molecular Properties

Compound Namemethyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate
PubChem CID31703569
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Namemethyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate
SMILESCOC(=O)c1ccc(NC(=O)c2cccc(C)n2)cc1
InChIInChI=1S/C15H14N2O3/c1-10-4-3-5-13(16-10)14(18)17-12-8-6-11(7-9-12)15(19)20-2/h3-9H,1-2H3,(H,17,18)
InChIKeyZYPSJECTVQYZKK-UHFFFAOYSA-N
XLogP2.43
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 4-methyl-3-[(6-methylpyridine-2-carbonyl)amino]benzoate
CID 32642709
N-(4-aminophenyl)-6-methylpyridine-2-carboxamide
CID 16784436
N-(4-iodophenyl)-6-methylpyridine-2-carboxamide
CID 31777667
methyl 2-fluoro-5-[(6-methylpyridine-2-carbonyl)amino]benzoate
CID 32709892
methyl 4-[[2-[(6-methyl-2-pyridinyl)amino]-1,3-thiazole-4-carbonyl]amino]benzoate
CID 90510028
methyl 4-[[6-(azepane-1-carbonyl)pyridine-2-carbonyl]amino]benzoate
CID 109099926
methyl 4-[[6-[methyl(phenyl)carbamoyl]pyridine-2-carbonyl]amino]benzoate
CID 109100281
methyl 4-[[6-(benzylcarbamoyl)pyridine-2-carbonyl]amino]benzoate
CID 109097311
methyl 4-[[6-(cyclohexylcarbamoyl)pyridine-2-carbonyl]amino]benzoate
CID 109095382
N-[4-(methanesulfonamido)phenyl]-6-methylpyridine-2-carboxamide
CID 32696107
methyl 4-[[2-(3-chloroanilino)-6-methylpyrimidine-4-carbonyl]amino]benzoate
CID 109337055
methyl 4-[[2-(2,6-dimethylanilino)pyrimidine-4-carbonyl]amino]benzoate
CID 109315289

Frequently Asked Questions

What is the IUPAC name of methyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate?
The IUPAC name of methyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate (CID 31703569) is methyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate.
What is the SMILES notation for methyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate?
The canonical SMILES for methyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate is COC(=O)c1ccc(NC(=O)c2cccc(C)n2)cc1.
What is the InChIKey of methyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate?
The InChIKey is ZYPSJECTVQYZKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-10-4-3-5-13(16-10)14(18)17-12-8-6-11(7-9-12)15(19)20-2/h3-9H,1-2H3,(H,17,18).
What are the key properties of methyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate?
methyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate has a molecular weight of 270.29 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-[(6-methylpyridine-2-carbonyl)amino]benzoate is sourced from PubChem (CID 31703569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).