2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide

C15H25N3O3 — CID 102914909

About 2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide

2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide (PubChem CID 102914909) has the molecular formula C15H25N3O3 and a molecular weight of 295.38 g/mol. Its IUPAC name is 2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide.

Molecular Properties

• Compound Name: 2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide
• PubChem CID: 102914909
• Molecular Formula: C15H25N3O3
• Molecular Weight: 295.38 g/mol
• Exact Mass: 295.19
• IUPAC Name: 2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide
• SMILES: CC(C)C(CNC(=O)Cn1ccc(=O)n(C)c1=O)C(C)C
• InChI: InChI=1S/C15H25N3O3/c1-10(2)12(11(3)4)8-16-13(19)9-18-7-6-14(20)17(5)15(18)21/h6-7,10-12H,8-9H2,1-5H3,(H,16,19)
• InChIKey: FVWOUFHUVCMBFP-UHFFFAOYSA-N
• XLogP: 0.59
• TPSA: 73.10 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	295.38
LogP ≤ 5	0.59
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide?

The IUPAC name of 2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide (CID 102914909) is 2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide.

What is the SMILES notation for 2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide?

The canonical SMILES for 2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide is CC(C)C(CNC(=O)Cn1ccc(=O)n(C)c1=O)C(C)C.

What is the InChIKey of 2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide?

The InChIKey is FVWOUFHUVCMBFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3/c1-10(2)12(11(3)4)8-16-13(19)9-18-7-6-14(20)17(5)15(18)21/h6-7,10-12H,8-9H2,1-5H3,(H,16,19).

What are the key properties of 2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide?

2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide has a molecular weight of 295.38 g/mol, XLogP of 0.59, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide is sourced from PubChem (CID 102914909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).