N'-(4,6-dimethylpyrimidin-2-yl)-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetohydrazide

C17H24N6O3 — CID 46688448

About N'-(4,6-dimethylpyrimidin-2-yl)-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetohydrazide

N'-(4,6-dimethylpyrimidin-2-yl)-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetohydrazide (PubChem CID 46688448) has the molecular formula C17H24N6O3 and a molecular weight of 360.42 g/mol. Its IUPAC name is N'-(4,6-dimethylpyrimidin-2-yl)-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetohydrazide.

Molecular Properties

• Compound Name: N'-(4,6-dimethylpyrimidin-2-yl)-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetohydrazide
• PubChem CID: 46688448
• Molecular Formula: C17H24N6O3
• Molecular Weight: 360.42 g/mol
• Exact Mass: 360.19
• IUPAC Name: N'-(4,6-dimethylpyrimidin-2-yl)-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetohydrazide
• SMILES: Cc1cc(C)nc(NNC(=O)CN2C(=O)NC3(CCCCC3C)C2=O)n1
• InChI: InChI=1S/C17H24N6O3/c1-10-6-4-5-7-17(10)14(25)23(16(26)20-17)9-13(24)21-22-15-18-11(2)8-12(3)19-15/h8,10H,4-7,9H2,1-3H3,(H,20,26)(H,21,24)(H,18,19,22)
• InChIKey: QBKKPLZNVTZRLK-UHFFFAOYSA-N
• XLogP: 1.04
• TPSA: 116.32 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	360.42
LogP ≤ 5	1.04
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N'-(4,6-dimethylpyrimidin-2-yl)-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetohydrazide?

The IUPAC name of N'-(4,6-dimethylpyrimidin-2-yl)-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetohydrazide (CID 46688448) is N'-(4,6-dimethylpyrimidin-2-yl)-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetohydrazide.

What is the SMILES notation for N'-(4,6-dimethylpyrimidin-2-yl)-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetohydrazide?

The canonical SMILES for N'-(4,6-dimethylpyrimidin-2-yl)-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetohydrazide is Cc1cc(C)nc(NNC(=O)CN2C(=O)NC3(CCCCC3C)C2=O)n1.

What is the InChIKey of N'-(4,6-dimethylpyrimidin-2-yl)-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetohydrazide?

The InChIKey is QBKKPLZNVTZRLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6O3/c1-10-6-4-5-7-17(10)14(25)23(16(26)20-17)9-13(24)21-22-15-18-11(2)8-12(3)19-15/h8,10H,4-7,9H2,1-3H3,(H,20,26)(H,21,24)(H,18,19,22).

What are the key properties of N'-(4,6-dimethylpyrimidin-2-yl)-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetohydrazide?

N'-(4,6-dimethylpyrimidin-2-yl)-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetohydrazide has a molecular weight of 360.42 g/mol, XLogP of 1.04, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N'-(4,6-dimethylpyrimidin-2-yl)-2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetohydrazide is sourced from PubChem (CID 46688448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).