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

C11H10N4O2 — CID 135419016

IUPACN-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)acetamide
SMILESCC(=O)Nc1cc(=O)[nH]c(-c2ccccn2)n1
InChIInChI=1S/C11H10N4O2/c1-7(16)13-9-6-10(17)15-11(14-9)8-4-2-3-5-12-8/h2-6H,1H3,(H2,13,14,15,16,17)
InChIKeyNYYXKVPYLFTAHK-UHFFFAOYSA-N
MW230.23 g/mol
LogP0.79
Rot. Bonds2

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

N-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)acetamide (PubChem CID 135419016) has the molecular formula C11H10N4O2 and a molecular weight of 230.23 g/mol. Its IUPAC name is N-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)acetamide.

Molecular Properties

Compound NameN-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)acetamide
PubChem CID135419016
Molecular FormulaC11H10N4O2
Molecular Weight230.23 g/mol
Exact Mass230.08
IUPAC NameN-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)acetamide
SMILESCC(=O)Nc1cc(=O)[nH]c(-c2ccccn2)n1
InChIInChI=1S/C11H10N4O2/c1-7(16)13-9-6-10(17)15-11(14-9)8-4-2-3-5-12-8/h2-6H,1H3,(H2,13,14,15,16,17)
InChIKeyNYYXKVPYLFTAHK-UHFFFAOYSA-N
XLogP0.79
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.23
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)acetamide?
The IUPAC name of N-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)acetamide (CID 135419016) is N-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)acetamide.
What is the SMILES notation for N-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)acetamide?
The canonical SMILES for N-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)acetamide is CC(=O)Nc1cc(=O)[nH]c(-c2ccccn2)n1.
What is the InChIKey of N-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)acetamide?
The InChIKey is NYYXKVPYLFTAHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O2/c1-7(16)13-9-6-10(17)15-11(14-9)8-4-2-3-5-12-8/h2-6H,1H3,(H2,13,14,15,16,17).
What are the key properties of N-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)acetamide?
N-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)acetamide has a molecular weight of 230.23 g/mol, XLogP of 0.79, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)acetamide is sourced from PubChem (CID 135419016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).