2,4-bis(hex-4-enyl)-1,3,5-triazine

C15H23N3 — CID 175384284

IUPAC2,4-bis(hex-4-enyl)-1,3,5-triazine
SMILESCC=CCCCc1ncnc(CCCC=CC)n1
InChIInChI=1S/C15H23N3/c1-3-5-7-9-11-14-16-13-17-15(18-14)12-10-8-6-4-2/h3-6,13H,7-12H2,1-2H3
InChIKeyJNZSPCIBAIXCLK-UHFFFAOYSA-N
MW245.37 g/mol
LogP3.67
Rot. Bonds8

About 2,4-bis(hex-4-enyl)-1,3,5-triazine

2,4-bis(hex-4-enyl)-1,3,5-triazine (PubChem CID 175384284) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is 2,4-bis(hex-4-enyl)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-bis(hex-4-enyl)-1,3,5-triazine
PubChem CID175384284
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC Name2,4-bis(hex-4-enyl)-1,3,5-triazine
SMILESCC=CCCCc1ncnc(CCCC=CC)n1
InChIInChI=1S/C15H23N3/c1-3-5-7-9-11-14-16-13-17-15(18-14)12-10-8-6-4-2/h3-6,13H,7-12H2,1-2H3
InChIKeyJNZSPCIBAIXCLK-UHFFFAOYSA-N
XLogP3.67
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2,4-bis(hex-4-enyl)-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 2,4-bis(hex-4-enyl)-1,3,5-triazine?
The IUPAC name of 2,4-bis(hex-4-enyl)-1,3,5-triazine (CID 175384284) is 2,4-bis(hex-4-enyl)-1,3,5-triazine.
What is the SMILES notation for 2,4-bis(hex-4-enyl)-1,3,5-triazine?
The canonical SMILES for 2,4-bis(hex-4-enyl)-1,3,5-triazine is CC=CCCCc1ncnc(CCCC=CC)n1.
What is the InChIKey of 2,4-bis(hex-4-enyl)-1,3,5-triazine?
The InChIKey is JNZSPCIBAIXCLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-3-5-7-9-11-14-16-13-17-15(18-14)12-10-8-6-4-2/h3-6,13H,7-12H2,1-2H3.
What are the key properties of 2,4-bis(hex-4-enyl)-1,3,5-triazine?
2,4-bis(hex-4-enyl)-1,3,5-triazine has a molecular weight of 245.37 g/mol, XLogP of 3.67, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis(hex-4-enyl)-1,3,5-triazine is sourced from PubChem (CID 175384284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).