N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide

C14H14N4O4 — CID 110700119

IUPACN-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)Cc2cc(=O)[nH]c(=O)[nH]2)cc1
InChIInChI=1S/C14H14N4O4/c1-8(19)15-9-2-4-10(5-3-9)16-12(20)6-11-7-13(21)18-14(22)17-11/h2-5,7H,6H2,1H3,(H,15,19)(H,16,20)(H2,17,18,21,22)
InChIKeyHWOGMXVKGWBNQA-UHFFFAOYSA-N
MW302.29 g/mol
LogP0.20
Rot. Bonds4

About N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide

N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide (PubChem CID 110700119) has the molecular formula C14H14N4O4 and a molecular weight of 302.29 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide
PubChem CID110700119
Molecular FormulaC14H14N4O4
Molecular Weight302.29 g/mol
Exact Mass302.10
IUPAC NameN-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)Cc2cc(=O)[nH]c(=O)[nH]2)cc1
InChIInChI=1S/C14H14N4O4/c1-8(19)15-9-2-4-10(5-3-9)16-12(20)6-11-7-13(21)18-14(22)17-11/h2-5,7H,6H2,1H3,(H,15,19)(H,16,20)(H2,17,18,21,22)
InChIKeyHWOGMXVKGWBNQA-UHFFFAOYSA-N
XLogP0.20
TPSA123.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.29
LogP ≤ 50.20
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,4-dioxo-1H-pyrimidin-6-yl)-N-[4-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 110700131
N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide
CID 166350115
N-(4-acetamidophenyl)-2,4-dioxo-1H-pyrimidine-6-carboxamide
CID 110698333
2-[[2-(2,4-dioxo-1H-pyrimidin-6-yl)acetyl]amino]benzoic acid
CID 43353075
3-[[2-(2,4-dioxo-1H-pyrimidin-6-yl)acetyl]amino]-4-methyl-N-(4-sulfamoylphenyl)benzamide
CID 162521060
N-(4-acetamidophenyl)-2-(2,5-dimethyl-1H-pyrrol-3-yl)acetamide
CID 110773570
2-(2,4-dioxo-1H-pyrimidin-6-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide
CID 102915109
6-(2-oxobutyl)-1H-pyrimidine-2,4-dione
CID 83856785
3-[[2-(2,4-dioxo-1H-pyrimidin-6-yl)acetyl]amino]pyrazine-2-carboxylic acid
CID 63261949
2-(2,4-dioxo-1H-pyrimidin-6-yl)-N-(3-hydroxy-2-methylpropyl)acetamide
CID 65037150
3-[[2-(2,4-dioxo-1H-pyrimidin-6-yl)acetyl]amino]-2,2-dimethylpropanoic acid
CID 115427228
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide
CID 110700152

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide (CID 110700119) is N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide is CC(=O)Nc1ccc(NC(=O)Cc2cc(=O)[nH]c(=O)[nH]2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide?
The InChIKey is HWOGMXVKGWBNQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O4/c1-8(19)15-9-2-4-10(5-3-9)16-12(20)6-11-7-13(21)18-14(22)17-11/h2-5,7H,6H2,1H3,(H,15,19)(H,16,20)(H2,17,18,21,22).
What are the key properties of N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide?
N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide has a molecular weight of 302.29 g/mol, XLogP of 0.20, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide is sourced from PubChem (CID 110700119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).