4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one

C15H14N4O2 — CID 140929059

IUPAC4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one
SMILESCOc1ccc(-c2ccn(C)c(=O)c2)c(-c2cn[nH]c2)n1
InChIInChI=1S/C15H14N4O2/c1-19-6-5-10(7-14(19)20)12-3-4-13(21-2)18-15(12)11-8-16-17-9-11/h3-9H,1-2H3,(H,16,17)
InChIKeyDWKSMPLCNHPOIE-UHFFFAOYSA-N
MW282.30 g/mol
LogP1.85
Rot. Bonds3

About 4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one

4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one (PubChem CID 140929059) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one.

Molecular Properties

Compound Name4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one
PubChem CID140929059
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one
SMILESCOc1ccc(-c2ccn(C)c(=O)c2)c(-c2cn[nH]c2)n1
InChIInChI=1S/C15H14N4O2/c1-19-6-5-10(7-14(19)20)12-3-4-13(21-2)18-15(12)11-8-16-17-9-11/h3-9H,1-2H3,(H,16,17)
InChIKeyDWKSMPLCNHPOIE-UHFFFAOYSA-N
XLogP1.85
TPSA72.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}

Analyze 4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one?
The IUPAC name of 4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one (CID 140929059) is 4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one.
What is the SMILES notation for 4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one?
The canonical SMILES for 4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one is COc1ccc(-c2ccn(C)c(=O)c2)c(-c2cn[nH]c2)n1.
What is the InChIKey of 4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one?
The InChIKey is DWKSMPLCNHPOIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-19-6-5-10(7-14(19)20)12-3-4-13(21-2)18-15(12)11-8-16-17-9-11/h3-9H,1-2H3,(H,16,17).
What are the key properties of 4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one?
4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one has a molecular weight of 282.30 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-methoxy-2-(1H-pyrazol-4-yl)-3-pyridinyl]-1-methylpyridin-2-one is sourced from PubChem (CID 140929059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).