1,3-dimethyl-6-[2-(2-methylpropyl)-3-oxo-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrimidine-2,4-dione

C19H28N4O4 — CID 72860462

About 1,3-dimethyl-6-[2-(2-methylpropyl)-3-oxo-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrimidine-2,4-dione

1,3-dimethyl-6-[2-(2-methylpropyl)-3-oxo-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrimidine-2,4-dione (PubChem CID 72860462) has the molecular formula C19H28N4O4 and a molecular weight of 376.46 g/mol. Its IUPAC name is 1,3-dimethyl-6-[2-(2-methylpropyl)-3-oxo-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrimidine-2,4-dione.

Molecular Properties

• Compound Name: 1,3-dimethyl-6-[2-(2-methylpropyl)-3-oxo-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrimidine-2,4-dione
• PubChem CID: 72860462
• Molecular Formula: C19H28N4O4
• Molecular Weight: 376.46 g/mol
• Exact Mass: 376.21
• IUPAC Name: 1,3-dimethyl-6-[2-(2-methylpropyl)-3-oxo-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrimidine-2,4-dione
• SMILES: CC(C)CN1CC2(CCN(C(=O)c3cc(=O)n(C)c(=O)n3C)CC2)CC1=O
• InChI: InChI=1S/C19H28N4O4/c1-13(2)11-23-12-19(10-16(23)25)5-7-22(8-6-19)17(26)14-9-15(24)21(4)18(27)20(14)3/h9,13H,5-8,10-12H2,1-4H3
• InChIKey: ZVJKTNZTALJJHT-UHFFFAOYSA-N
• XLogP: 0.19
• TPSA: 84.62 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	376.46
LogP ≤ 5	0.19
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-6-[2-(2-methylpropyl)-3-oxo-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrimidine-2,4-dione?

The IUPAC name of 1,3-dimethyl-6-[2-(2-methylpropyl)-3-oxo-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrimidine-2,4-dione (CID 72860462) is 1,3-dimethyl-6-[2-(2-methylpropyl)-3-oxo-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrimidine-2,4-dione.

What is the SMILES notation for 1,3-dimethyl-6-[2-(2-methylpropyl)-3-oxo-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrimidine-2,4-dione?

The canonical SMILES for 1,3-dimethyl-6-[2-(2-methylpropyl)-3-oxo-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrimidine-2,4-dione is CC(C)CN1CC2(CCN(C(=O)c3cc(=O)n(C)c(=O)n3C)CC2)CC1=O.

What is the InChIKey of 1,3-dimethyl-6-[2-(2-methylpropyl)-3-oxo-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrimidine-2,4-dione?

The InChIKey is ZVJKTNZTALJJHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O4/c1-13(2)11-23-12-19(10-16(23)25)5-7-22(8-6-19)17(26)14-9-15(24)21(4)18(27)20(14)3/h9,13H,5-8,10-12H2,1-4H3.

What are the key properties of 1,3-dimethyl-6-[2-(2-methylpropyl)-3-oxo-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrimidine-2,4-dione?

1,3-dimethyl-6-[2-(2-methylpropyl)-3-oxo-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrimidine-2,4-dione has a molecular weight of 376.46 g/mol, XLogP of 0.19, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 1,3-dimethyl-6-[2-(2-methylpropyl)-3-oxo-2,8-diazaspiro[4.5]decane-8-carbonyl]pyrimidine-2,4-dione is sourced from PubChem (CID 72860462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).