methyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate

C13H14N4O4 — CID 166330492

IUPACmethyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate
SMILESCOC(=O)c1cc(NC(=O)c2ccc(C)[nH]c2=O)nn1C
InChIInChI=1S/C13H14N4O4/c1-7-4-5-8(11(18)14-7)12(19)15-10-6-9(13(20)21-3)17(2)16-10/h4-6H,1-3H3,(H,14,18)(H,15,16,19)
InChIKeyKXDZYLIFRNVEOF-UHFFFAOYSA-N
MW290.28 g/mol
LogP0.46
Rot. Bonds3

About methyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate

methyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate (PubChem CID 166330492) has the molecular formula C13H14N4O4 and a molecular weight of 290.28 g/mol. Its IUPAC name is methyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate.

Molecular Properties

Compound Namemethyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate
PubChem CID166330492
Molecular FormulaC13H14N4O4
Molecular Weight290.28 g/mol
Exact Mass290.10
IUPAC Namemethyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate
SMILESCOC(=O)c1cc(NC(=O)c2ccc(C)[nH]c2=O)nn1C
InChIInChI=1S/C13H14N4O4/c1-7-4-5-8(11(18)14-7)12(19)15-10-6-9(13(20)21-3)17(2)16-10/h4-6H,1-3H3,(H,14,18)(H,15,16,19)
InChIKeyKXDZYLIFRNVEOF-UHFFFAOYSA-N
XLogP0.46
TPSA106.08 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.28
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze methyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate with MolForge

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Related Compounds

N-(4-methoxy-2-pyridinyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 75434501
methyl 3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]benzoate
CID 115584192
N-(4-amino-3-methoxyphenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 115736650
N-(3-bromo-4-fluorophenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 71993657
methyl 2-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]acetate
CID 115584292
N-[4-(3-hydroxyprop-1-ynyl)-2-pyridinyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 102821026
N-(3-bromo-5-methylphenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 104938593
N-(3-hydroxy-4-methylphenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 115701467
N-(4-bromo-3-fluorophenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 113241584
methyl 5-(6-methyl-2-oxo-1H-pyridine-3-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxylate
CID 50963781
N-(4-bromo-2,6-difluorophenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 115666671
4-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]benzoic acid
CID 115590008

Frequently Asked Questions

What is the IUPAC name of methyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate?
The IUPAC name of methyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate (CID 166330492) is methyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate.
What is the SMILES notation for methyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate?
The canonical SMILES for methyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate is COC(=O)c1cc(NC(=O)c2ccc(C)[nH]c2=O)nn1C.
What is the InChIKey of methyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate?
The InChIKey is KXDZYLIFRNVEOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O4/c1-7-4-5-8(11(18)14-7)12(19)15-10-6-9(13(20)21-3)17(2)16-10/h4-6H,1-3H3,(H,14,18)(H,15,16,19).
What are the key properties of methyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate?
methyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate has a molecular weight of 290.28 g/mol, XLogP of 0.46, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 1-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]pyrazole-5-carboxylate is sourced from PubChem (CID 166330492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).