2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide

C13H14N4O2 — CID 45496934

IUPAC2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide
SMILESCc1cc(=O)n(CC(=O)Nc2cccc(C)n2)cn1
InChIInChI=1S/C13H14N4O2/c1-9-4-3-5-11(15-9)16-12(18)7-17-8-14-10(2)6-13(17)19/h3-6,8H,7H2,1-2H3,(H,15,16,18)
InChIKeyPHFDSULJVPAXGS-UHFFFAOYSA-N
MW258.28 g/mol
LogP0.89
Rot. Bonds3

About 2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide

2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide (PubChem CID 45496934) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is 2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide
PubChem CID45496934
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide
SMILESCc1cc(=O)n(CC(=O)Nc2cccc(C)n2)cn1
InChIInChI=1S/C13H14N4O2/c1-9-4-3-5-11(15-9)16-12(18)7-17-8-14-10(2)6-13(17)19/h3-6,8H,7H2,1-2H3,(H,15,16,18)
InChIKeyPHFDSULJVPAXGS-UHFFFAOYSA-N
XLogP0.89
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide (CID 45496934) is 2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide is Cc1cc(=O)n(CC(=O)Nc2cccc(C)n2)cn1.
What is the InChIKey of 2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide?
The InChIKey is PHFDSULJVPAXGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-9-4-3-5-11(15-9)16-12(18)7-17-8-14-10(2)6-13(17)19/h3-6,8H,7H2,1-2H3,(H,15,16,18).
What are the key properties of 2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide?
2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide has a molecular weight of 258.28 g/mol, XLogP of 0.89, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-6-oxopyrimidin-1-yl)-N-(6-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 45496934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).