tris(prop-2-enamide);1,3,5-triazine

C12H18N6O3 — CID 70620459

IUPACtris(prop-2-enamide);1,3,5-triazine
SMILESC=CC(N)=O.C=CC(N)=O.C=CC(N)=O.c1ncncn1
InChIInChI=1S/C3H3N3.3C3H5NO/c1-4-2-6-3-5-1;3*1-2-3(4)5/h1-3H;3*2H,1H2,(H2,4,5)
InChIKeyYDJLSVDRKFRZMZ-UHFFFAOYSA-N
MW294.32 g/mol
LogP-1.16
Rot. Bonds3

About tris(prop-2-enamide);1,3,5-triazine

tris(prop-2-enamide);1,3,5-triazine (PubChem CID 70620459) has the molecular formula C12H18N6O3 and a molecular weight of 294.32 g/mol. Its IUPAC name is tris(prop-2-enamide);1,3,5-triazine.

Molecular Properties

Compound Nametris(prop-2-enamide);1,3,5-triazine
PubChem CID70620459
Molecular FormulaC12H18N6O3
Molecular Weight294.32 g/mol
Exact Mass294.14
IUPAC Nametris(prop-2-enamide);1,3,5-triazine
SMILESC=CC(N)=O.C=CC(N)=O.C=CC(N)=O.c1ncncn1
InChIInChI=1S/C3H3N3.3C3H5NO/c1-4-2-6-3-5-1;3*1-2-3(4)5/h1-3H;3*2H,1H2,(H2,4,5)
InChIKeyYDJLSVDRKFRZMZ-UHFFFAOYSA-N
XLogP-1.16
TPSA167.94 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.32
LogP ≤ 5-1.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze tris(prop-2-enamide);1,3,5-triazine 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 tris(prop-2-enamide);1,3,5-triazine?
The IUPAC name of tris(prop-2-enamide);1,3,5-triazine (CID 70620459) is tris(prop-2-enamide);1,3,5-triazine.
What is the SMILES notation for tris(prop-2-enamide);1,3,5-triazine?
The canonical SMILES for tris(prop-2-enamide);1,3,5-triazine is C=CC(N)=O.C=CC(N)=O.C=CC(N)=O.c1ncncn1.
What is the InChIKey of tris(prop-2-enamide);1,3,5-triazine?
The InChIKey is YDJLSVDRKFRZMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3N3.3C3H5NO/c1-4-2-6-3-5-1;3*1-2-3(4)5/h1-3H;3*2H,1H2,(H2,4,5).
What are the key properties of tris(prop-2-enamide);1,3,5-triazine?
tris(prop-2-enamide);1,3,5-triazine has a molecular weight of 294.32 g/mol, XLogP of -1.16, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tris(prop-2-enamide);1,3,5-triazine is sourced from PubChem (CID 70620459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).