1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione

C9H9N3O3 — CID 15156517

IUPAC1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione
SMILESC=Cn1c(=O)n(C=C)c(=O)n(C=C)c1=O
InChIInChI=1S/C9H9N3O3/c1-4-10-7(13)11(5-2)9(15)12(6-3)8(10)14/h4-6H,1-3H2
InChIKeyWQDQPWGZOLWVLM-UHFFFAOYSA-N
MW207.19 g/mol
LogP-0.53
Rot. Bonds3

About 1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione

1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione (PubChem CID 15156517) has the molecular formula C9H9N3O3 and a molecular weight of 207.19 g/mol. Its IUPAC name is 1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione.

Molecular Properties

Compound Name1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione
PubChem CID15156517
Molecular FormulaC9H9N3O3
Molecular Weight207.19 g/mol
Exact Mass207.06
IUPAC Name1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione
SMILESC=Cn1c(=O)n(C=C)c(=O)n(C=C)c1=O
InChIInChI=1S/C9H9N3O3/c1-4-10-7(13)11(5-2)9(15)12(6-3)8(10)14/h4-6H,1-3H2
InChIKeyWQDQPWGZOLWVLM-UHFFFAOYSA-N
XLogP-0.53
TPSA66.00 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.19
LogP ≤ 5-0.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione?
The IUPAC name of 1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione (CID 15156517) is 1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione.
What is the SMILES notation for 1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione?
The canonical SMILES for 1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione is C=Cn1c(=O)n(C=C)c(=O)n(C=C)c1=O.
What is the InChIKey of 1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione?
The InChIKey is WQDQPWGZOLWVLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O3/c1-4-10-7(13)11(5-2)9(15)12(6-3)8(10)14/h4-6H,1-3H2.
What are the key properties of 1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione?
1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione has a molecular weight of 207.19 g/mol, XLogP of -0.53, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione is sourced from PubChem (CID 15156517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).