N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide

C7H9N3O2 — CID 135515053

IUPACN-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide
SMILESCC(=O)Nc1cc(=O)[nH]c(C)n1
InChIInChI=1S/C7H9N3O2/c1-4-8-6(10-5(2)11)3-7(12)9-4/h3H,1-2H3,(H2,8,9,10,11,12)
InChIKeyZWRGJARLRINZIM-UHFFFAOYSA-N
MW167.17 g/mol
LogP0.04
Rot. Bonds1

About N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide

N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide (PubChem CID 135515053) has the molecular formula C7H9N3O2 and a molecular weight of 167.17 g/mol. Its IUPAC name is N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide.

Molecular Properties

Compound NameN-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide
PubChem CID135515053
Molecular FormulaC7H9N3O2
Molecular Weight167.17 g/mol
Exact Mass167.07
IUPAC NameN-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide
SMILESCC(=O)Nc1cc(=O)[nH]c(C)n1
InChIInChI=1S/C7H9N3O2/c1-4-8-6(10-5(2)11)3-7(12)9-4/h3H,1-2H3,(H2,8,9,10,11,12)
InChIKeyZWRGJARLRINZIM-UHFFFAOYSA-N
XLogP0.04
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide?
The IUPAC name of N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide (CID 135515053) is N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide.
What is the SMILES notation for N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide?
The canonical SMILES for N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide is CC(=O)Nc1cc(=O)[nH]c(C)n1.
What is the InChIKey of N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide?
The InChIKey is ZWRGJARLRINZIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2/c1-4-8-6(10-5(2)11)3-7(12)9-4/h3H,1-2H3,(H2,8,9,10,11,12).
What are the key properties of N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide?
N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide has a molecular weight of 167.17 g/mol, XLogP of 0.04, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-6-oxo-1H-pyrimidin-4-yl)acetamide is sourced from PubChem (CID 135515053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).