2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine

C10H12N8 — CID 54570221

IUPAC2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine
SMILESc1ncnc(C2CNCCN2c2ncncn2)n1
InChIInChI=1S/C10H12N8/c1-2-18(10-16-6-13-7-17-10)8(3-11-1)9-14-4-12-5-15-9/h4-8,11H,1-3H2
InChIKeyZWSJFLNQEOJIGS-UHFFFAOYSA-N
MW244.26 g/mol
LogP-0.79
Rot. Bonds2

About 2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine

2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine (PubChem CID 54570221) has the molecular formula C10H12N8 and a molecular weight of 244.26 g/mol. Its IUPAC name is 2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine.

Molecular Properties

Compound Name2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine
PubChem CID54570221
Molecular FormulaC10H12N8
Molecular Weight244.26 g/mol
Exact Mass244.12
IUPAC Name2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine
SMILESc1ncnc(C2CNCCN2c2ncncn2)n1
InChIInChI=1S/C10H12N8/c1-2-18(10-16-6-13-7-17-10)8(3-11-1)9-14-4-12-5-15-9/h4-8,11H,1-3H2
InChIKeyZWSJFLNQEOJIGS-UHFFFAOYSA-N
XLogP-0.79
TPSA92.61 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.26
LogP ≤ 5-0.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine?
The IUPAC name of 2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine (CID 54570221) is 2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine.
What is the SMILES notation for 2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine?
The canonical SMILES for 2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine is c1ncnc(C2CNCCN2c2ncncn2)n1.
What is the InChIKey of 2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine?
The InChIKey is ZWSJFLNQEOJIGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N8/c1-2-18(10-16-6-13-7-17-10)8(3-11-1)9-14-4-12-5-15-9/h4-8,11H,1-3H2.
What are the key properties of 2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine?
2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine has a molecular weight of 244.26 g/mol, XLogP of -0.79, 2 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(1,3,5-triazin-2-yl)piperazin-2-yl]-1,3,5-triazine is sourced from PubChem (CID 54570221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).