2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide

C16H15N5O2 — CID 122300315

IUPAC2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide
SMILESCOc1ccccc1CC(=O)Nc1cnc(-n2cccn2)nc1
InChIInChI=1S/C16H15N5O2/c1-23-14-6-3-2-5-12(14)9-15(22)20-13-10-17-16(18-11-13)21-8-4-7-19-21/h2-8,10-11H,9H2,1H3,(H,20,22)
InChIKeyJXEWWNCCEMIJDE-UHFFFAOYSA-N
MW309.33 g/mol
LogP1.85
Rot. Bonds5

About 2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide

2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide (PubChem CID 122300315) has the molecular formula C16H15N5O2 and a molecular weight of 309.33 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide
PubChem CID122300315
Molecular FormulaC16H15N5O2
Molecular Weight309.33 g/mol
Exact Mass309.12
IUPAC Name2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide
SMILESCOc1ccccc1CC(=O)Nc1cnc(-n2cccn2)nc1
InChIInChI=1S/C16H15N5O2/c1-23-14-6-3-2-5-12(14)9-15(22)20-13-10-17-16(18-11-13)21-8-4-7-19-21/h2-8,10-11H,9H2,1H3,(H,20,22)
InChIKeyJXEWWNCCEMIJDE-UHFFFAOYSA-N
XLogP1.85
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide
CID 53493772
2-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)acetamide
CID 122298244
N-(2-pyrazol-1-ylpyrimidin-5-yl)butanamide
CID 91967761
2-(2,4-difluorophenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide
CID 122300328
2-(2-methoxyphenyl)-N-(2-methylpyrazol-3-yl)acetamide
CID 112536636
N-(2-pyrazol-1-ylpyrimidin-5-yl)-2-pyrrol-1-ylacetamide
CID 122300366
2-(2-methoxyphenyl)-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide
CID 39695127
2-(2-methoxyphenyl)-N-(2-methyl-4-pyridinyl)acetamide
CID 110756856
7-methoxy-N-(2-pyrazol-1-ylpyrimidin-5-yl)-1-benzofuran-2-carboxamide
CID 122300248
N-(4-imidazol-1-ylphenyl)-2-(2-methoxyphenyl)acetamide
CID 31409632
2-(1,3-benzodioxol-5-yl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide
CID 122300316
N-(2-pyrazol-1-ylpyrimidin-5-yl)pyridine-2-carboxamide
CID 71789796

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide?
The IUPAC name of 2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide (CID 122300315) is 2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide.
What is the SMILES notation for 2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide?
The canonical SMILES for 2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide is COc1ccccc1CC(=O)Nc1cnc(-n2cccn2)nc1.
What is the InChIKey of 2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide?
The InChIKey is JXEWWNCCEMIJDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O2/c1-23-14-6-3-2-5-12(14)9-15(22)20-13-10-17-16(18-11-13)21-8-4-7-19-21/h2-8,10-11H,9H2,1H3,(H,20,22).
What are the key properties of 2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide?
2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide has a molecular weight of 309.33 g/mol, XLogP of 1.85, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide is sourced from PubChem (CID 122300315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).