2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide

C7H9N3O2 — CID 819887

IUPAC2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide
SMILESCc1ncc(CC(N)=O)c(=O)[nH]1
InChIInChI=1S/C7H9N3O2/c1-4-9-3-5(2-6(8)11)7(12)10-4/h3H,2H2,1H3,(H2,8,11)(H,9,10,12)
InChIKeyMNGLBIDUZMKABZ-UHFFFAOYSA-N
MW167.17 g/mol
LogP-0.89
Rot. Bonds2

About 2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide

2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide (PubChem CID 819887) has the molecular formula C7H9N3O2 and a molecular weight of 167.17 g/mol. Its IUPAC name is 2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide.

Molecular Properties

Compound Name2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide
PubChem CID819887
Molecular FormulaC7H9N3O2
Molecular Weight167.17 g/mol
Exact Mass167.07
IUPAC Name2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide
SMILESCc1ncc(CC(N)=O)c(=O)[nH]1
InChIInChI=1S/C7H9N3O2/c1-4-9-3-5(2-6(8)11)7(12)10-4/h3H,2H2,1H3,(H2,8,11)(H,9,10,12)
InChIKeyMNGLBIDUZMKABZ-UHFFFAOYSA-N
XLogP-0.89
TPSA88.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 5-0.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide?
The IUPAC name of 2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide (CID 819887) is 2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide.
What is the SMILES notation for 2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide?
The canonical SMILES for 2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide is Cc1ncc(CC(N)=O)c(=O)[nH]1.
What is the InChIKey of 2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide?
The InChIKey is MNGLBIDUZMKABZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2/c1-4-9-3-5(2-6(8)11)7(12)10-4/h3H,2H2,1H3,(H2,8,11)(H,9,10,12).
What are the key properties of 2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide?
2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide has a molecular weight of 167.17 g/mol, XLogP of -0.89, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide is sourced from PubChem (CID 819887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).