methyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate

C14H15N3O3 — CID 166563672

IUPACmethyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate
SMILESCOC(=O)c1ccc(=O)n(-c2cn(C)nc2C2CC2)c1
InChIInChI=1S/C14H15N3O3/c1-16-8-11(13(15-16)9-3-4-9)17-7-10(14(19)20-2)5-6-12(17)18/h5-9H,3-4H2,1-2H3
InChIKeyOWLQBVGLIQRJOI-UHFFFAOYSA-N
MW273.29 g/mol
LogP1.24
Rot. Bonds3

About methyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate

methyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate (PubChem CID 166563672) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is methyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate
PubChem CID166563672
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Namemethyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate
SMILESCOC(=O)c1ccc(=O)n(-c2cn(C)nc2C2CC2)c1
InChIInChI=1S/C14H15N3O3/c1-16-8-11(13(15-16)9-3-4-9)17-7-10(14(19)20-2)5-6-12(17)18/h5-9H,3-4H2,1-2H3
InChIKeyOWLQBVGLIQRJOI-UHFFFAOYSA-N
XLogP1.24
TPSA66.12 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze methyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 1-(2-fluorophenyl)-6-oxopyridine-3-carboxylate
CID 163348793
methyl 4-[2-(3-cyclopropyl-6-oxopyridazin-1-yl)ethylcarbamoyl]benzoate
CID 122277941
methyl 3-cyclopentyl-1-methylindazole-5-carboxylate
CID 171772847
methyl 3-(3-cyclopropyl-1-methylpyrazol-4-yl)prop-2-ynoate
CID 66509576
methyl 4-(4-methyl-1,4,5-triazatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)benzoate
CID 84613359
methyl 1-methyl-6-sulfanylidenepyridine-3-carboxylate
CID 901960
ethyl 3-cyclohexyl-1-methylpyrazole-4-carboxylate
CID 146167576
methyl 3-(1,3-dimethylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylate
CID 102802259
N-(3-cyclopropyl-1-methylpyrazol-4-yl)-3-methoxy-1-methylpyrazole-4-carboxamide
CID 167856488
methyl 1-[2-(cyclopentylamino)-2-oxoethyl]-6-oxopyridine-3-carboxylate
CID 24609506
methyl 3-cyclopropyl-1,2-benzoxazole-5-carboxylate
CID 156503323
3-cyclopropyl-4-ethyl-1-methylpyrazole
CID 126759747

Frequently Asked Questions

What is the IUPAC name of methyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate?
The IUPAC name of methyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate (CID 166563672) is methyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate.
What is the SMILES notation for methyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate?
The canonical SMILES for methyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate is COC(=O)c1ccc(=O)n(-c2cn(C)nc2C2CC2)c1.
What is the InChIKey of methyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate?
The InChIKey is OWLQBVGLIQRJOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c1-16-8-11(13(15-16)9-3-4-9)17-7-10(14(19)20-2)5-6-12(17)18/h5-9H,3-4H2,1-2H3.
What are the key properties of methyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate?
methyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate has a molecular weight of 273.29 g/mol, XLogP of 1.24, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 1-(3-cyclopropyl-1-methylpyrazol-4-yl)-6-oxopyridine-3-carboxylate is sourced from PubChem (CID 166563672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).