N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide

C13H13N3O3 — CID 115679434

IUPACN-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide
SMILESCOc1ccc(NC(=O)Cn2cnccc2=O)cc1
InChIInChI=1S/C13H13N3O3/c1-19-11-4-2-10(3-5-11)15-12(17)8-16-9-14-7-6-13(16)18/h2-7,9H,8H2,1H3,(H,15,17)
InChIKeyLAHYSBGXWSBKTA-UHFFFAOYSA-N
MW259.27 g/mol
LogP0.89
Rot. Bonds4

About N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide

N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide (PubChem CID 115679434) has the molecular formula C13H13N3O3 and a molecular weight of 259.27 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide
PubChem CID115679434
Molecular FormulaC13H13N3O3
Molecular Weight259.27 g/mol
Exact Mass259.10
IUPAC NameN-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide
SMILESCOc1ccc(NC(=O)Cn2cnccc2=O)cc1
InChIInChI=1S/C13H13N3O3/c1-19-11-4-2-10(3-5-11)15-12(17)8-16-9-14-7-6-13(16)18/h2-7,9H,8H2,1H3,(H,15,17)
InChIKeyLAHYSBGXWSBKTA-UHFFFAOYSA-N
XLogP0.89
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.27
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide 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

2-(6-oxopyrimidin-1-yl)-N-phenylacetamide
CID 115679497
N-(4-ethylphenyl)-2-(6-oxopyrimidin-1-yl)acetamide
CID 121064147
N-[4-(dimethylamino)phenyl]-2-(6-oxopyrimidin-1-yl)acetamide
CID 121064222
N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide
CID 55028374
N-(3-fluorophenyl)-2-(6-oxopyrimidin-1-yl)acetamide
CID 115679426
N-(3-chlorophenyl)-2-(6-oxopyrimidin-1-yl)acetamide
CID 115679492
N-(4-methoxyphenyl)-2-pyridin-4-ylacetamide
CID 110697333
N-(cyanomethyl)-2-(6-oxopyrimidin-1-yl)acetamide
CID 115679462
2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-(4-methoxyphenyl)acetamide
CID 122278381
N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-(6-oxopyrimidin-1-yl)acetamide
CID 121064198
2-(3,4-dihydroxypyrrolidin-1-yl)-N-(4-methoxyphenyl)acetamide
CID 106671846
2-(3-amino-1,2,4-triazol-1-yl)-N-(4-methoxyphenyl)acetamide
CID 60911192

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide?
The IUPAC name of N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide (CID 115679434) is N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide is COc1ccc(NC(=O)Cn2cnccc2=O)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide?
The InChIKey is LAHYSBGXWSBKTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O3/c1-19-11-4-2-10(3-5-11)15-12(17)8-16-9-14-7-6-13(16)18/h2-7,9H,8H2,1H3,(H,15,17).
What are the key properties of N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide?
N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide has a molecular weight of 259.27 g/mol, XLogP of 0.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 115679434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).