Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one

C9H19N3O — CID 35522

About Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one

Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one (PubChem CID 35522) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is 4,6-di(propan-2-yl)-1,3,5-triazinan-2-one.

Molecular Properties

• Compound Name: Tetrahydro-4,6-diisopropyl-S-triazin-2(1H)-one
• PubChem CID: 35522
• Molecular Formula: C9H19N3O
• Molecular Weight: 185.27 g/mol
• Exact Mass: 185.15
• IUPAC Name: 4,6-di(propan-2-yl)-1,3,5-triazinan-2-one
• SMILES: CC(C)C1NC(NC(=O)N1)C(C)C
• InChIKey: RNBQTUYBVNJSMA-UHFFFAOYSA-N
• XLogP: 1.70
• TPSA: 53.20 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 2
• Rotatable Bonds: 2
• Heavy Atoms: 13
• Complexity: 173

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	185.27
LogP ≤ 5	1.70
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	2