2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine

C9H12N6 — CID 57438000

IUPAC2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine
SMILESC=CNc1nc(NC=C)nc(NC=C)n1
InChIInChI=1S/C9H12N6/c1-4-10-7-13-8(11-5-2)15-9(14-7)12-6-3/h4-6H,1-3H2,(H3,10,11,12,13,14,15)
InChIKeyDEXVIXGHYYVZBS-UHFFFAOYSA-N
MW204.24 g/mol
LogP1.54
Rot. Bonds6

About 2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine

2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 57438000) has the molecular formula C9H12N6 and a molecular weight of 204.24 g/mol. Its IUPAC name is 2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine
PubChem CID57438000
Molecular FormulaC9H12N6
Molecular Weight204.24 g/mol
Exact Mass204.11
IUPAC Name2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine
SMILESC=CNc1nc(NC=C)nc(NC=C)n1
InChIInChI=1S/C9H12N6/c1-4-10-7-13-8(11-5-2)15-9(14-7)12-6-3/h4-6H,1-3H2,(H3,10,11,12,13,14,15)
InChIKeyDEXVIXGHYYVZBS-UHFFFAOYSA-N
XLogP1.54
TPSA74.76 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.24
LogP ≤ 51.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine 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 2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine (CID 57438000) is 2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine is C=CNc1nc(NC=C)nc(NC=C)n1.
What is the InChIKey of 2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine?
The InChIKey is DEXVIXGHYYVZBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N6/c1-4-10-7-13-8(11-5-2)15-9(14-7)12-6-3/h4-6H,1-3H2,(H3,10,11,12,13,14,15).
What are the key properties of 2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine?
2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 204.24 g/mol, XLogP of 1.54, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N,6-N-tris(ethenyl)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 57438000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).