2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide

C15H20N4O3 — CID 71709110

IUPAC2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide
SMILESCc1cc(=O)c(OCC(=O)NCc2c(C)nn(C)c2C)c[nH]1
InChIInChI=1S/C15H20N4O3/c1-9-5-13(20)14(7-16-9)22-8-15(21)17-6-12-10(2)18-19(4)11(12)3/h5,7H,6,8H2,1-4H3,(H,16,20)(H,17,21)
InChIKeyIDRWTPJXAAGDRM-UHFFFAOYSA-N
MW304.35 g/mol
LogP0.73
Rot. Bonds5

About 2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide

2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide (PubChem CID 71709110) has the molecular formula C15H20N4O3 and a molecular weight of 304.35 g/mol. Its IUPAC name is 2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide.

Molecular Properties

Compound Name2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide
PubChem CID71709110
Molecular FormulaC15H20N4O3
Molecular Weight304.35 g/mol
Exact Mass304.15
IUPAC Name2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide
SMILESCc1cc(=O)c(OCC(=O)NCc2c(C)nn(C)c2C)c[nH]1
InChIInChI=1S/C15H20N4O3/c1-9-5-13(20)14(7-16-9)22-8-15(21)17-6-12-10(2)18-19(4)11(12)3/h5,7H,6,8H2,1-4H3,(H,16,20)(H,17,21)
InChIKeyIDRWTPJXAAGDRM-UHFFFAOYSA-N
XLogP0.73
TPSA89.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide?
The IUPAC name of 2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide (CID 71709110) is 2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide.
What is the SMILES notation for 2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide?
The canonical SMILES for 2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide is Cc1cc(=O)c(OCC(=O)NCc2c(C)nn(C)c2C)c[nH]1.
What is the InChIKey of 2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide?
The InChIKey is IDRWTPJXAAGDRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3/c1-9-5-13(20)14(7-16-9)22-8-15(21)17-6-12-10(2)18-19(4)11(12)3/h5,7H,6,8H2,1-4H3,(H,16,20)(H,17,21).
What are the key properties of 2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide?
2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide has a molecular weight of 304.35 g/mol, XLogP of 0.73, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-methyl-4-oxo-1H-pyridin-3-yl)oxy]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]acetamide is sourced from PubChem (CID 71709110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).