2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide

C7H9N3O3 — CID 18474133

IUPAC2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide
SMILESCc1cn(CC(N)=O)c(=O)[nH]c1=O
InChIInChI=1S/C7H9N3O3/c1-4-2-10(3-5(8)11)7(13)9-6(4)12/h2H,3H2,1H3,(H2,8,11)(H,9,12,13)
InChIKeyPMIDULFHOJMDCD-UHFFFAOYSA-N
MW183.17 g/mol
LogP-1.67
Rot. Bonds2

About 2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide

2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide (PubChem CID 18474133) has the molecular formula C7H9N3O3 and a molecular weight of 183.17 g/mol. Its IUPAC name is 2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound Name2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide
PubChem CID18474133
Molecular FormulaC7H9N3O3
Molecular Weight183.17 g/mol
Exact Mass183.06
IUPAC Name2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide
SMILESCc1cn(CC(N)=O)c(=O)[nH]c1=O
InChIInChI=1S/C7H9N3O3/c1-4-2-10(3-5(8)11)7(13)9-6(4)12/h2H,3H2,1H3,(H2,8,11)(H,9,12,13)
InChIKeyPMIDULFHOJMDCD-UHFFFAOYSA-N
XLogP-1.67
TPSA97.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.17
LogP ≤ 5-1.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
The IUPAC name of 2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide (CID 18474133) is 2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide.
What is the SMILES notation for 2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
The canonical SMILES for 2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide is Cc1cn(CC(N)=O)c(=O)[nH]c1=O.
What is the InChIKey of 2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
The InChIKey is PMIDULFHOJMDCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O3/c1-4-2-10(3-5(8)11)7(13)9-6(4)12/h2H,3H2,1H3,(H2,8,11)(H,9,12,13).
What are the key properties of 2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide has a molecular weight of 183.17 g/mol, XLogP of -1.67, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 18474133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).