2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide

C16H15N5O3 — CID 53493772

IUPAC2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide
SMILESCOc1ccccc1CC(=O)Nc1cnc(-n2cccn2)[nH]c1=O
InChIInChI=1S/C16H15N5O3/c1-24-13-6-3-2-5-11(13)9-14(22)19-12-10-17-16(20-15(12)23)21-8-4-7-18-21/h2-8,10H,9H2,1H3,(H,19,22)(H,17,20,23)
InChIKeyHLDZGWQYDGQXEH-UHFFFAOYSA-N
MW325.33 g/mol
LogP1.15
Rot. Bonds5

About 2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide

2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide (PubChem CID 53493772) has the molecular formula C16H15N5O3 and a molecular weight of 325.33 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide
PubChem CID53493772
Molecular FormulaC16H15N5O3
Molecular Weight325.33 g/mol
Exact Mass325.12
IUPAC Name2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide
SMILESCOc1ccccc1CC(=O)Nc1cnc(-n2cccn2)[nH]c1=O
InChIInChI=1S/C16H15N5O3/c1-24-13-6-3-2-5-11(13)9-14(22)19-12-10-17-16(20-15(12)23)21-8-4-7-18-21/h2-8,10H,9H2,1H3,(H,19,22)(H,17,20,23)
InChIKeyHLDZGWQYDGQXEH-UHFFFAOYSA-N
XLogP1.15
TPSA101.90 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.33
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2-methoxyphenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide
CID 122300315
2-phenylethyl N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)carbamate
CID 67458571
2-(2-methoxyphenyl)-N-(2-methylpyrazol-3-yl)acetamide
CID 112536636
3-methoxy-2-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)benzamide
CID 67453274
N-(7-fluoro-4-oxo-3H-quinazolin-6-yl)-2-(2-methoxyphenyl)acetamide
CID 135903572
2-(2-methoxyphenyl)-N-(2-methyl-1,2,4-triazol-3-yl)acetamide
CID 71917325
N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methoxyphenyl)acetamide
CID 112697113
2-(4-fluorophenyl)-N-[5-[(2-methoxyphenyl)methylamino]-2-pyridinyl]acetamide
CID 113027342
2-(2-methoxyphenyl)-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide
CID 39695127
2-(2-methoxyphenyl)-N-(2,4,5-trichlorophenyl)acetamide
CID 3375078
N-(4-fluoro-2-methoxyphenyl)-2-(2-methoxyphenyl)acetamide
CID 32608110
2-(2,5-dimethoxyphenyl)-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]acetamide
CID 78817314

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide?
The IUPAC name of 2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide (CID 53493772) is 2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide.
What is the SMILES notation for 2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide?
The canonical SMILES for 2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide is COc1ccccc1CC(=O)Nc1cnc(-n2cccn2)[nH]c1=O.
What is the InChIKey of 2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide?
The InChIKey is HLDZGWQYDGQXEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O3/c1-24-13-6-3-2-5-11(13)9-14(22)19-12-10-17-16(20-15(12)23)21-8-4-7-18-21/h2-8,10H,9H2,1H3,(H,19,22)(H,17,20,23).
What are the key properties of 2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide?
2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide has a molecular weight of 325.33 g/mol, XLogP of 1.15, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-N-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)acetamide is sourced from PubChem (CID 53493772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).